SCHEMBL7189848

SCHEMBL7189848

C=Cc1c(C)c(C)cc2ccccc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 6/20 0.45
CYP2A6 P11509 4/20 0.45
TSHR P16473 2/20 0.42
ALDH1A1 P00352 4/20 0.40
HSD17B10 Q99714 3/20 0.40
HPGD P15428 2/20 0.40
NR1I2 O75469 1/20 0.37
HIF1A Q16665 2/20 0.37
CYP1B1 Q16678 1/20 0.37
KDM4E B2RXH2 2/20 0.36
GAA P10253 1/20 0.36
AMY1A P0DUB6 1/20 0.36
CCR1 P32246 1/20 0.35
CCR8 P51685 1/20 0.35
KMT2A Q03164 1/20 0.35
GRIN2D O15399 1/20 0.35
GRIN3B O60391 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2A Q12879 1/20 0.35
GRIN2B Q13224 1/20 0.35

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
SCHEMBL23428803 0.88 CYP1A2 (0.45) CYP1A2CYP2A6TSHRALDH1A1HSD17B10
SCHEMBL814435 0.84 CYP1A2 (0.45) CYP1A2CYP2A6TSHRALDH1A1HSD17B10
SCHEMBL1055398 0.82 CYP1A2 (0.48) CYP1A2CYP2A6TSHRALDH1A1HSD17B10
SCHEMBL295337 0.82 CYP1A2 (0.44) CYP1A2CYP2A6TSHRALDH1A1HSD17B10
SCHEMBL9572163 0.82 CYP1A2 (0.40) CYP1A2CYP2A6TSHRALDH1A1HSD17B10
SCHEMBL179766 0.81 AMY1A (0.46) CYP1A2CYP2A6TSHRALDH1A1HSD17B10
SCHEMBL29948626 0.81 AMY1A (0.46) CYP1A2CYP2A6TSHRALDH1A1HSD17B10
SCHEMBL23428989 0.80 CYP1A2 (0.39) CYP1A2CYP2A6TSHRALDH1A1HSD17B10
SCHEMBL10337571 0.79 CYP1A2 (0.41) CYP1A2CYP2A6ALDH1A1HSD17B10HPGD
SCHEMBL1699305 0.79 CYP2A6 (0.41) CYP1A2CYP2A6TSHRALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6534595-B2 Blend of thermosetting resin, decomposable resin and solvent SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-03-18 US disclosed
US-20010038887-A1 Coating solution for forming porous organic film SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-11-08 US disclosed
EP-0904300-A1 PROTECTED FUNCTIONALIZED TELECHELIC POLYMERS AND PROCESSES FOR MAKING THE SAME FMC CORPORATION (US) 1999-03-31 EP disclosed
WO-1998002465-A1 PROTECTED FUNCTIONALIZED HETEROTELECHELIC POLYMERS AND PROCESSES FOR PREPARING THE SAME SCHWINDEMAN JAMES A (US) 1998-01-22 WO disclosed
WO-1997048731-A1 PROTECTED FUNCTIONALIZED TELECHELIC POLYMERS AND PROCESSES FOR MAKING THE SAME FMC CORPORATION (US) 1997-12-24 WO disclosed
WO-1997023520-A1 FUNCTIONALIZED CHAIN EXTENDED INITIATORS FOR ANIONIC POLYMERIZATION FMC CORPORATION (US) 1997-07-03 WO disclosed
EP-0529166-A1 Electrorheological fluids NIPPON SHOKUBAI CO., LTD. (JP) 1993-03-03 EP disclosed