SCHEMBL135604

SCHEMBL135604

C(=Cc1ccc(C=Cc2ccncc2)cc1)c1ccncc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.65
NPC1 O15118 4/20 0.65
RAB9A P51151 3/20 0.65
SMN1; SMN2 Q16637 3/20 0.65
HPGD P15428 2/20 0.65
CYP1A2 P05177 2/20 0.65
MEN1 O00255 1/20 0.65
ALOX15 P16050 1/20 0.65
CASP1 P29466 1/20 0.65
HBB P68871 1/20 0.65
KMT2A Q03164 1/20 0.65
KDM4E B2RXH2 1/20 0.65
CYP3A4 P08684 1/20 0.65
CYP2D6 P10635 1/20 0.65
CYP2C9 P11712 1/20 0.65
CYP2C19 P33261 1/20 0.65
KDM1A O60341 1/20 0.58
HDAC1 Q13547 1/20 0.58
HDAC6 Q9UBN7 1/20 0.58
JUN P05412 1/20 0.56

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9966009 1.00 MAPT (0.65) MAPTNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL107198 0.97 MAPT (0.61) MAPTNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL138489 0.97 MAPT (0.61) MAPTNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL31175769 0.93 MAPT (0.58) MAPTNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL24759909 0.89 CYP11B2 (0.60) MAPTNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL9928791 0.89 CYP17A1 (0.62) MAPTNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL9928792 0.89 CYP17A1 (0.62) MAPTNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL15901869 0.88 CYP1A2 (0.61) MAPTNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL13907337 0.88 MAPT (0.54) MAPTNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL10452019 0.88 MAPT (0.54) MAPTNPC1RAB9ASMN1; SMN2HPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 37 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12636634-B2 Fluorinated MOF materials having rectangular channels, method of synthesizing MOF materials and methods of using MOF materials including for CO2 capture KING ABDULLAH UNIVERSITY OF SCIENCE AND TECHNOLOGY (SA) 2026-05-26 US claimed
WO-2024196666-A1 FLUORINATED MOF MATERIALS HAVING RECTANGULAR CHANNELS, METHOD OF SYNTHESIZING MOF MATERIALS AND METHODS OF USING MOF MATERIALS INCLUDING FOR CO2 CAPTURE KING ABDULLAH UNIVERSITY OF SCIENCE AND TECHNOLOGY (SA) 2024-09-26 WO claimed
US-20240316530-A1 FLUORINATED MOF MATERIALS HAVING RECTANGULAR CHANNELS, METHOD OF SYNTHESIZING MOF MATERIALS AND METHODS OF USING MOF MATERIALS INCLUDING FOR CO2 CAPTURE KING ABDULLAH UNIVERSITY OF SCIENCE AND TECHNOLOGY (SA) 2024-09-26 US claimed
US-20150303390-A1 SEQUENCE DEPENDENT ASSEMBLY TO CONTROL MOLECULAR INTERFACE PROPERTIES FOR MEMORY DEVICES, SOLAR CELLS AND MOLECULAR DIODES YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2015-10-22 US claimed
EP-2909871-A2 SEQUENCE DEPENDENT ASSEMBLY TO CONTROL MOLECULAR INTERFACE PROPERTIES FOR MEMORY DEVICES, SOLAR CELLS AND MOLECULAR DIODES Yeda Research and Development Co. Ltd (IL) 2015-08-26 EP claimed
WO-2014061018-A2 SEQUENCE DEPENDENT ASSEMBLY TO CONTROL MOLECULAR INTERFACE PROPERTIES FOR MEMORY DEVICES, SOLAR CELLS AND MOLECULAR DIODES YEDA RESEARCH AND DEVELOPMENT CO. LTD AT THE WEIZMANN INSTITUTE OF SCIENCE (IL) 2014-04-24 WO claimed
WO-2009098001-A1 ORGANOMETALLIC SKELETON COMPOUNDS ON THE BASIS OF TRIPTYCENE BAYER MATERIALSCIENCE AG (DE) 2009-08-13 WO claimed
US-12636634-B2 Fluorinated MOF materials having rectangular channels, method of synthesizing MOF materials and methods of using MOF materials including for CO2 capture KING ABDULLAH UNIVERSITY OF SCIENCE AND TECHNOLOGY (SA) 2026-05-26 US disclosed
WO-2024196666-A1 FLUORINATED MOF MATERIALS HAVING RECTANGULAR CHANNELS, METHOD OF SYNTHESIZING MOF MATERIALS AND METHODS OF USING MOF MATERIALS INCLUDING FOR CO2 CAPTURE KING ABDULLAH UNIVERSITY OF SCIENCE AND TECHNOLOGY (SA) 2024-09-26 WO disclosed
US-20240316530-A1 FLUORINATED MOF MATERIALS HAVING RECTANGULAR CHANNELS, METHOD OF SYNTHESIZING MOF MATERIALS AND METHODS OF USING MOF MATERIALS INCLUDING FOR CO2 CAPTURE KING ABDULLAH UNIVERSITY OF SCIENCE AND TECHNOLOGY (SA) 2024-09-26 US disclosed
CN-118085309-A Pb-organic hybrid material containing metal oxide clusters, preparation method thereof and application thereof in preparation of yellow light LED 重庆师范大学 2024-05-28 CN disclosed
CN-116333334-B Porous MOF non-rare earth light conversion material, preparation method thereof and application thereof in preparation of red light-near infrared light device 重庆师范大学 2024-05-28 CN disclosed
CN-117720742-A 6-connected porous Zn-MOF material, preparation method thereof and application thereof in preparation of red light LED 重庆师范大学 2024-03-19 CN disclosed
US-20120156491-A1 SERS Reporter Molecules and Methods CABOT SECURITY MATERIALS INC. (US) 2012-06-21 US disclosed
EP-2433131-A1 PARTICLES AND METHODS FOR LONG WAVELENGTH SERS Cabot Security Materials Inc. (US) 2012-03-28 EP disclosed
US-20120057165-A1 Particles and Methods for Long Wavelength SERS CABOT SECURITY MATERIALS INC. (US) 2012-03-08 US disclosed
WO-2010135354-A1 PARTICLES AND METHODS FOR LONG WAVELENGTH SERS OXONICA MATERIALS INC. (US) 2010-11-25 WO disclosed
WO-2009098001-A1 ORGANOMETALLIC SKELETON COMPOUNDS ON THE BASIS OF TRIPTYCENE BAYER MATERIALSCIENCE AG (DE) 2009-08-13 WO disclosed
CN-1213314-C Surface reinforced lamman scattering active liquid core optical fibre, method for making and use UNIV JILIN (CN) 2005-08-03 CN disclosed
CN-1448742-A Surface reinforced Lamman scattering active liquid core optical fibre, method for making and use UNIV JILIN (CN) 2003-10-15 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12636634-B2 Fluorinated MOF materials having rectangular channels, method of synthesizing MOF materials and methods of using MOF materials including for CO2 capture MLX, BMP4, F13B MAPT 4241/4885NPC1 3006/4885RAB9A 1857/4885
US-20120156491-A1 SERS Reporter Molecules and Methods SRRT, MYCBP, SPR MAPT 2191/4885NPC1 2242/4885RAB9A 1597/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.