SCHEMBL15723349

SCHEMBL15723349

CCCCCCCCC(C)COc1ccc2ccccc2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CETP P11597 1/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ AGXT P21549 2/20 0.44
▸ PPARG P37231 4/20 0.43
▸ PPARA Q07869 4/20 0.43
▸ KDM1A O60341 2/20 0.43
▸ MAPK1 P28482 3/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ GPBAR1 Q8TDU6 2/20 0.42
▸ ALOX5 P09917 2/20 0.41
▸ TP53 P04637 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ NFKB1 P19838 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ HIF1A Q16665 1/20 0.41

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
SCHEMBL28949610 0.83 LTA4H (0.50) MAPK1CYP3A4HIF1AALDH1A1LMNA
SCHEMBL6679788 0.83 LTA4H (0.50) MAPK1CYP3A4HIF1AALDH1A1LMNA
SCHEMBL15723346 0.81 RAB9A (0.41) NPC1RAB9AAGXTPPARGPPARA
SCHEMBL14113223 0.81 GPBAR1 (0.58) NPC1RAB9AAGXTKDM1AMAPK1
SCHEMBL6686112 0.81 LMNA (0.52) MAPK1CYP3A4HIF1AALDH1A1LMNA
SCHEMBL27768843 0.80 ALOX5 (0.49) CETPNPC1RAB9AAGXTPPARG
SCHEMBL28730788 0.80 LTA4H (0.47) MAPK1CYP3A4HIF1AALDH1A1LMNA
SCHEMBL28730793 0.80 LTA4H (0.47) MAPK1CYP3A4HIF1AALDH1A1LMNA
SCHEMBL28730787 0.80 LTA4H (0.47) MAPK1CYP3A4HIF1AALDH1A1LMNA
SCHEMBL8072669 0.80 PLA2G4B (0.54) KDM4ETP53TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140138253-A1 COMPOSITION AND METHOD FOR THE DEPOSITION OF CONDUCTIVE POLYMERS ON DIELECTRIC SUBSTRATES ENTHONE INC. (US) 2014-05-22 — — US disclosed
Send feedback