SCHEMBL2046255

SCHEMBL2046255

Cc1c[c]c2c(c1)-c1ccccc1C2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.39
CYP3A4 P08684 1/20 0.39
ALDH1A1 P00352 5/20 0.38
HPGD P15428 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
MAPT P10636 2/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
KDM4E B2RXH2 2/20 0.38
LMNA P02545 1/20 0.38
MAOA P21397 2/20 0.37
ADRA2A P08913 1/20 0.37
SLC6A2 P23975 1/20 0.37
HTR2C P28335 1/20 0.37
SLC6A4 P31645 1/20 0.37
HTR2B P41595 1/20 0.37
BCHE P06276 1/20 0.37
CES1 P23141 1/20 0.37
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 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
SCHEMBL714161 0.84 METAP1 (0.43) ALDH1A1HPGDSMN1; SMN2MAPTRAB9A
SCHEMBL8162708 0.78 ALDH1A1 (0.42) CYP1A2CYP3A4ALDH1A1HPGDSMN1; SMN2
SCHEMBL2051685 0.78 ALDH1A1 (0.38) CYP1A2CYP3A4ALDH1A1HPGDSMN1; SMN2
SCHEMBL2051734 0.77 CYP1A2 (0.38) CYP1A2CYP3A4ALDH1A1HPGDSMN1; SMN2
SCHEMBL218437 0.71 ALDH1A1 (0.38) CYP1A2CYP3A4ALDH1A1HPGDSMN1; SMN2
SCHEMBL547186 0.71 ALDH1A1 (0.53) CYP1A2CYP3A4ALDH1A1HPGDSMN1; SMN2
SCHEMBL23903 0.71 MAOA (0.41) CYP1A2CYP3A4ALDH1A1HPGDSMN1; SMN2
SCHEMBL5557865 0.70 METAP2 (0.38) CYP1A2CYP3A4ALDH1A1HPGDSMN1; SMN2
SCHEMBL27626677 0.69 MAOA (0.40) CYP1A2CYP3A4ALDH1A1HPGDSMN1; SMN2
SCHEMBL496744 0.69 NPC1 (0.39) CYP1A2CYP3A4ALDH1A1HPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110152463-A1 RESIN COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-06-23 US disclosed
US-20100093957-A1 METHOD FOR PRODUCING BUTENE-ETHYLENE COPOLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-15 US disclosed
EP-2123685-A1 METHOD FOR PRODUCING BUTENE-ETHYLENE COPOLYMER Sumitomo Chemical Company, Limited (JP) 2009-11-25 EP disclosed