SCHEMBL12640663

SCHEMBL12640663

CCCCc1cc2c(cc1O)OCO2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 2/20 0.50
CYP3A4 P08684 3/20 0.46
ALDH1A1 P00352 3/20 0.46
TSHR P16473 2/20 0.46
HTT P42858 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
TP53 P04637 1/20 0.43
ALOX5 P09917 1/20 0.43
MAPT P10636 1/20 0.43
ALOX15 P16050 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
SCN1A P35498 1/20 0.43
SCN2A Q99250 1/20 0.43
SCN3A Q9NY46 1/20 0.43
PKM P14618 1/20 0.42
GAA P10253 3/20 0.40
HPGD P15428 2/20 0.40
MAPK1 P28482 2/20 0.40
NPC1 O15118 1/20 0.40

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
SCHEMBL18029916 0.95 TYR (0.50) TYRCYP3A4ALDH1A1TSHRHTT
SCHEMBL1276072 0.89 CYP3A4 (0.49) CYP3A4ALDH1A1TSHRHTTMEN1
SCHEMBL14284022 0.84 CYP3A4 (0.46) TYRCYP3A4MEN1KMT2ATDP1
SCHEMBL18633195 0.81 ALDH1A1 (0.50) TYRCYP3A4ALDH1A1TSHRMEN1
SCHEMBL772701 0.80 HSP90AA1 (0.51) CYP3A4TSHRHTTMEN1KMT2A
SCHEMBL156399 0.80 TYR (0.65) TYRCYP3A4ALDH1A1TSHRHTT
SCHEMBL22702252 0.78 CYP3A4 (0.46) CYP3A4ALDH1A1TSHRMEN1KMT2A
SCHEMBL3382419 0.78 TYR (0.63) TYRCYP3A4ALDH1A1TSHRHTT
SCHEMBL1395658 0.76 CYP3A4 (0.72) TYRCYP3A4ALDH1A1TSHRHTT
SCHEMBL10790730 0.76 TYR (0.61) TYRCYP3A4ALDH1A1TSHRHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7968495-B2 Heat-sensitive transfer image-receiving sheet and producing method thereof FUJIFILM CORPORATION (JP) 2011-06-28 US disclosed
US-20080014434-A1 Heat-sensitive transfer image-receiving sheet and producing method thereof FUJIFILM CORPORATION (JP) 2008-01-17 US disclosed