SCHEMBL255410

SCHEMBL255410

Cc1ccc(/C=N/c2ccc(C)cc2)cc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.74
CA2 P00918 4/20 0.67
PTGS2 P35354 3/20 0.67
CA9 Q16790 2/20 0.67
PTGS1 P23219 1/20 0.67
CA12 O43570 1/20 0.67
SMN1; SMN2 Q16637 4/20 0.61
NPC1 O15118 2/20 0.61
RAB9A P51151 2/20 0.61
KDM4E B2RXH2 4/20 0.59
L3MBTL1 Q9Y468 3/20 0.59
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
MAPT P10636 2/20 0.59
NPSR1 Q6W5P4 2/20 0.59
TP53 P04637 1/20 0.59
THRB P10828 1/20 0.59
ALOX15 P16050 1/20 0.59
MAPK1 P28482 1/20 0.59
HSD17B10 Q99714 1/20 0.59

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
SCHEMBL11588746 1.00 ALDH1A1 (0.74) ALDH1A1CA2PTGS2CA9PTGS1
SCHEMBL12633723 1.00 ALDH1A1 (0.74) ALDH1A1CA2PTGS2CA9PTGS1
SCHEMBL20186922 1.00 ALDH1A1 (0.74) ALDH1A1CA2PTGS2CA9PTGS1
SCHEMBL11557679 1.00 ALDH1A1 (0.74) ALDH1A1CA2PTGS2CA9PTGS1
SCHEMBL28162394 0.91 ALDH1A1 (0.65) ALDH1A1CA2PTGS2CA9PTGS1
SCHEMBL14129141 0.91 ALDH1A1 (0.65) ALDH1A1CA2PTGS2CA9PTGS1
SCHEMBL13351563 0.89 ALDH1A1 (0.62) ALDH1A1CA2PTGS2CA9PTGS1
SCHEMBL18688365 0.89 ALDH1A1 (0.62) ALDH1A1CA2PTGS2CA9PTGS1
SCHEMBL11458614 0.89 S100B (0.66) ALDH1A1CA2PTGS2CA9PTGS1
SCHEMBL22366969 0.89 ALDH1A1 (0.62) ALDH1A1CA2PTGS2CA9PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3707132-B1 NEW METHOD FOR THE SYNTHESIS OF UNSYMMETRICAL TERTIARY AMINES UNIV PARIS SACLAY (FR) 2024-07-17 EP disclosed
US-20220325053-A1 METHOD FOR THE SYNTHESIS OF A TWO-DIMENSIONAL OR QUASI-TWO-DIMENSIONAL POLYMER FILM, THE TWO-DIMENSIONAL OR QUASI-TWO-DIMENSIONAL POLYMER FILM AND THE USE Technische Universität Dresden (DE) 2022-10-13 US disclosed
US-11034646-B2 Method for the synthesis of unsymmetrical tertiary amines Universite Paris-Saclay (FR) 2021-06-15 US disclosed
WO-2021028429-A1 METHOD FOR THE SYNTHESIS OF A TWO-DIMENSIONAL OR QUASI-TWO-DIMENSIONAL POLYMER FILM, THE TWO-DIMENSIONAL OR QUASI-TWO-DIMENSIONAL POLYMER FILM AND THE USE Technische Universität Dresden (DE) 2021-02-18 WO disclosed
US-20200255369-A1 NEW METHOD FOR THE SYNTHESIS OF UNSYMMETRICAL TERTIARY AMINES Universite Paris-Saclay (FR) 2020-08-13 US disclosed
US-10335765-B2 Complex of carbon structure and covalent organic framework, preparation method therefor, and use thereof KOREA INSTITUTE OF INDUSTRIAL TECHNOLOGY (KR) 2019-07-02 US disclosed
EP-2131233-B1 LIQUID CRYSTAL DISPLAY DEVICE AND POLYMER FOR ALIGNING FILM MATERIAL SHARP KK (JP) 2017-03-29 EP disclosed
US-8623855-B2 Azetidinone compounds and medical use thereof ZHEJIANG HISUN PHARMACEUTICAL CO., LTD. (CN) 2014-01-07 US disclosed
US-20130170016-A1 PHOTOREFRACTIVE DEVICE CONTAINING A CHROMOPHORE-DOPED POLYMER LAYER AND ITS MANUFACTURING METHOD NITTO DENKO CORPORATION (JP) 2013-07-04 US disclosed
US-20130163086-A1 SYSTEMS AND METHODS FOR IMPROVING THE PERFORMANCE OF A PHOTOREFRACTIVE DEVICE BY UTILIZING ELECTROLYTES NITTO DENKO CORPORATION (JP) 2013-06-27 US disclosed
US-7960435-B2 Anti-cancer agents and androgen inhibition activity compound UNIVERSITY OF MARYLAND, BALTIMORE (US) 2011-06-14 US disclosed
US-20100113600-A1 ANTI-CANCER AGENTS AND ANDROGEN INHIBITION ACTIVITY COMPOUND UNIVERSITY OF MARYLAND, BALTIMORE (US) 2010-05-06 US disclosed
US-20100102299-A1 ORGANIC SEMICONDUCTOR COMPOSITE, ORGANIC TRANSISTOR MATERIAL AND ORGANIC FIELD EFFECT TRANSISTOR TORAY INDUSTRIES, INC. (JP) 2010-04-29 US disclosed
US-20100102299-A1 ORGANIC SEMICONDUCTOR COMPOSITE, ORGANIC TRANSISTOR MATERIAL AND ORGANIC FIELD EFFECT TRANSISTOR TORAY INDUSTRIES, INC. (JP) 2010-04-29 US disclosed
US-20100096603-A1 OPTICAL DEVICES RESPONSIVE TO NEAR INFRARED LASER AND METHODS OF MODULATING LIGHT NITTO DENKO CORPORATION (JP) 2010-04-22 US disclosed
US-20100096603-A1 OPTICAL DEVICES RESPONSIVE TO NEAR INFRARED LASER AND METHODS OF MODULATING LIGHT NITTO DENKO CORPORATION (JP) 2010-04-22 US disclosed
US-20090306196-A1 IMINE BASED LIQUID CRYSTALS FOR THE CONTROLLED RELEASE OF BIOACTIVE MATERIALS FIRMENICH SA (CH) 2009-12-10 US disclosed
WO-2009099898-A1 OPTICAL DEVICES RESPONSIVE TO BLUE LASER AND METHOD OF MODULATING LIGHT NITTO DENKO CORPORATION (JP) 2009-08-13 WO disclosed
US-20090197186-A1 OPTICAL DEVICES RESPONSIVE TO BLUE LASER AND METHOD OF MODULATING LIGHT NITTO DENKO CORPORATION (JP) 2009-08-06 US disclosed
US-20090197186-A1 OPTICAL DEVICES RESPONSIVE TO BLUE LASER AND METHOD OF MODULATING LIGHT NITTO DENKO CORPORATION (JP) 2009-08-06 US 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 (4 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-20200255369-A1 NEW METHOD FOR THE SYNTHESIS OF UNSYMMETRICAL TERTIARY AMINES ADH1C, ADH1A, ADH5 ALDH1A1 179/4885CA2 4835/4885PTGS2 3275/4885
US-11034646-B2 Method for the synthesis of unsymmetrical tertiary amines ADH1C, PNMT, ADH1A ALDH1A1 182/4885CA2 4822/4885PTGS2 3092/4885
US-20090306196-A1 IMINE BASED LIQUID CRYSTALS FOR THE CONTROLLED RELEASE OF BIOACTIVE MATERIALS BCHE, ACHE, LIPE ALDH1A1 3124/4885CA2 714/4885PTGS2 3599/4885
US-20100113600-A1 ANTI-CANCER AGENTS AND ANDROGEN INHIBITION ACTIVITY COMPOUND AR, HTR3D, NR5A1 ALDH1A1 763/4885CA2 2614/4885PTGS2 513/4885

“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.