SCHEMBL8169341

SCHEMBL8169341

Bc1cnc2ccccc2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.57
PDGFRB P09619 3/20 0.50
PDGFRA P16234 3/20 0.50
MGAM O43451 1/20 0.50
ALDH1A1 P00352 4/20 0.48
GLA P06280 1/20 0.48
MAPT P10636 1/20 0.48
HPGD P15428 1/20 0.48
ACHE P22303 1/20 0.48
CYP2A6 P11509 1/20 0.47
BIRC5 O15392 1/20 0.46
KDM4E B2RXH2 1/20 0.45
GPR3 P46089 1/20 0.45
EGFR P00533 1/20 0.45
PIK3CD O00329 1/20 0.44
PIK3CA P42336 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
CYP11B1 P15538 1/20 0.43
CYP11B2 P19099 1/20 0.43
RAB9A P51151 1/20 0.43

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
SCHEMBL272937 0.79 CYP1A2 (0.59) CYP1A2PDGFRBPDGFRAMGAMALDH1A1
SCHEMBL25056734 0.78 PDGFRB (0.66) CYP1A2PDGFRBPDGFRACYP2A6BIRC5
SCHEMBL2772360 0.76 PDGFRB (0.77) CYP1A2PDGFRBPDGFRAMGAMALDH1A1
SCHEMBL32667946 0.76 PDGFRB (0.77) CYP1A2PDGFRBPDGFRAMGAMALDH1A1
SCHEMBL2937 0.73 CYP1A2 (0.57) CYP1A2PDGFRBPDGFRAMGAMALDH1A1
SCHEMBL271715 0.73 BIRC5 (0.59) CYP1A2PDGFRBPDGFRAMGAMALDH1A1
SCHEMBL438735 0.73 CYP1A2 (0.57) CYP1A2PDGFRBPDGFRAMGAMALDH1A1
SCHEMBL14678 0.73 CYP1A2 (0.57) CYP1A2PDGFRBPDGFRAMGAMALDH1A1
SCHEMBL372216 0.73 CYP1A2 (0.57) CYP1A2PDGFRBPDGFRAMGAMALDH1A1
SCHEMBL2938 0.73 CYP1A2 (1.00) CYP1A2PDGFRBPDGFRAMGAMALDH1A1

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022169218-A1 METHOD FOR PREPARATION OF DEUTERATED ANTHRACENE COMPOUND, REACTION COMPOSITION, DEUTERATED ANTHRACENE COMPOUND, AND COMPOSITION 주식회사 엘지화학 2022-08-11 WO disclosed
CN-108822034-A A kind of carbamide derivative and its application in prevention and treatment inflammation 王若锴 2018-11-16 CN disclosed
US-20170244049-A1 ORGANIC LIGHT-EMITTING DIODE MATERIALS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2017-08-24 US disclosed
EP-3037424-A1 NOVEL QUINOLINE-SUBSTITUTED COMPOUND Taiho Pharmaceutical Co., Ltd. (JP) 2016-06-29 EP disclosed
EP-2722332-B1 QUINOLYLPYRROLOPYRIMIDYL FUSED-RING COMPOUND OR SALT THEREOF TAIHO PHARMACEUTICAL CO LTD (JP) 2016-04-20 EP disclosed
WO-2015025936-A1 NOVEL QUINOLINE-SUBSTITUTED COMPOUND 大鵬薬品工業株式会社 (JP) 2015-02-26 WO disclosed
US-8945820-B2 Silicon-containing resist underlayer film-forming composition and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2015-02-03 US disclosed
WO-2015008866-A1 TRIAZINE COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT CONTAINING SAME 東ソー株式会社 (JP) 2015-01-22 WO disclosed
EP-2722332-A1 QUINOLYLPYRROLOPYRIMIDYL FUSED-RING COMPOUND OR SALT THEREOF Taiho Pharmaceutical Co., Ltd. (JP) 2014-04-23 EP disclosed
WO-2013125709-A1 QUINOLYLPYRROLOPYRIMIDYL FUSED-RING COMPOUND OR SALT THEREOF 大鵬薬品工業株式会社 (JP) 2013-08-29 WO disclosed
US-20130137271-A1 SILICON-CONTAINING RESIST UNDERLAYER FILM-FORMING COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2013-05-30 US disclosed
WO-2011163610-A2 ANTIMICROBIAL AGENTS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2011-12-29 WO disclosed
WO-2008073929-A1 ION CHANNEL MODULATORS WYETH (US) 2008-06-19 WO 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-20170244049-A1 ORGANIC LIGHT-EMITTING DIODE MATERIALS CYBA, DDT, DRD1 CYP1A2 763/4885PDGFRB 2768/4885PDGFRA 3456/4885

“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.