SCHEMBL325965

SCHEMBL325965

c1ccc(Cc2ccc3ccc4cccc5ccc2c3c45)cc1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
CYP1A2 P05177 3/20 0.46
ERBB2 P04626 1/20 0.46
FYN P06241 1/20 0.46
MAOA P21397 1/20 0.46
ACHE P22303 1/20 0.46
AHR P35869 1/20 0.46
ALDH1A1 P00352 4/20 0.45
KDM4E B2RXH2 1/20 0.45
HPGD P15428 3/20 0.45
HSD17B10 Q99714 3/20 0.45
THRB P10828 1/20 0.45
CYP3A4 P08684 2/20 0.44
TSHR P16473 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CYP1A1 P04798 1/20 0.42
CYP1B1 Q16678 1/20 0.42

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
Formaldehyde SCHEMBL29038646 0.95 KMT2A (0.51) MEN1KMT2ACYP1A2ERBB2FYN
SCHEMBL21438669 0.92 MEN1 (0.50) MEN1KMT2ACYP1A2ERBB2FYN
SCHEMBL10795218 0.87 CYP1A2 (0.43) MEN1KMT2ACYP1A2ERBB2FYN
SCHEMBL25334951 0.86 KMT2A (0.55) MEN1KMT2ACYP1A2ERBB2FYN
SCHEMBL7698304 0.85 MEN1 (0.43) MEN1KMT2AALDH1A1KDM4E
SCHEMBL11440835 0.85 CYP1A2 (0.52) MEN1KMT2ACYP1A2ERBB2FYN
SCHEMBL27633062 0.84 MEN1 (0.41) MEN1KMT2A
SCHEMBL29041190 0.84 MEN1 (0.47) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL27653491 0.84 MEN1 (0.41) MEN1KMT2A
SCHEMBL3930862 0.84 ALDH1A1 (0.48) MEN1KMT2ACYP1A2ERBB2FYN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9758646-B2 NdBR wet masterbatch ARLANXEO DEUTSCHLAND GMBH (DE) 2017-09-12 US claimed
CN-105001467-A NdBR wet masterbatch and preparing method and use thereof LANXESS DEUTSCHLAND GMBH 2015-10-28 CN claimed
US-20140309332-A1 NDBR WET MASTERBATCH ARLANXEO DEUTSCHLAND GMBH (DE) 2014-10-16 US claimed
EP-2773692-A1 NDBR WET MASTERBATCH LANXESS Deutschland GmbH (DE) 2014-09-10 EP claimed
CN-103958575-A NDBR wet masterbatch LANXESS DEUTSCHLAND GMBH 2014-07-30 CN claimed
WO-2013064434-A1 NDBR WET MASTERBATCH LANXESS DEUTSCHLAND GMBH (DE) 2013-05-10 WO claimed
WO-2013066329-A1 NdBR WET MASTERBATCH LANXESS DEUTSCHLAND GMBH (DE) 2013-05-10 WO claimed
CN-1955164-A Cell adhesion-inhibiting antiinflammatory and immune-suppressive compounds ABBOTT LAB (US) 2007-05-02 CN claimed
CN-1113434-A Drug DROSSAPHARM AG (CH) 1995-12-20 CN claimed
WO-2023230531-A1 METHODS FOR DETECTING CIRCULATING GENETICALLY ABNORMAL CELLS LUNGLIFE AI, INC. (US) 2023-11-30 WO disclosed
US-20230266325-A1 METHODS FOR DETECTING LUNG CANCER LUNGLIFE AI, INC. 2023-08-24 US disclosed
CN-116477731-A Flocculant for removing COD in coal gasification phenol-containing wastewater and preparation method thereof 内蒙古南大环保科技有限公司 2023-07-25 CN disclosed
US-11685702-B2 Method for producing arene compounds and arene compounds produced by the same JSI SILICONE CO. (KR) 2023-06-27 US disclosed
CN-116161809-A Separation method of coking desulfurization waste liquid 常州德帝士环保科技有限公司 2023-05-26 CN disclosed
US-20060078885-A1 Detection and diagnosis of smoking related cancers NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2006-04-13 US disclosed
US-6797471-B2 SCREENING FOR TUMORS IN HUMANS; OBTAIN SAMPLE, INCUBATE WITH PROBES, MONITORING ABBERATIONS IN HYDRIDIZATION PATTERN COMPAREDE TO CONTROL BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2004-09-28 US disclosed
US-20020081612-A1 Detection and diagnosis of smoking related cancers BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2002-06-27 US disclosed
WO-2002012563-A2 DETECTION AND DIAGNOSIS OF SMOKING RELATED CANCERS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2002-02-14 WO disclosed
CN-1113434-A Drug DROSSAPHARM AG (CH) 1995-12-20 CN disclosed
US-4636212-A COPOLYMER OF METHYL METHACRYLATE AND BENZOPHENONE DERIVATIVE IN MATRIX OF POLYMETHYL METHACRYLATE OPTICAL RADIATION CORPORATION (US) 1987-01-13 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 (1 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-11685702-B2 Method for producing arene compounds and arene compounds produced by the same PFAS, FRK, AGPAT2 MEN1 853/4885KMT2A 801/4885CYP1A2 303/4885

“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.