SCHEMBL17565178

SCHEMBL17565178

Cc1cc(C)c(OCCO)c(Cc2cc(C)cc(C(C)(C)C)c2OCCO)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPA5 P11021 1/20 0.47
CYP2C9 P11712 2/20 0.46
CYP2C19 P33261 2/20 0.46
HIF1A Q16665 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
CYP2D6 P10635 2/20 0.46
HSD17B10 Q99714 2/20 0.46
HTR1A P08908 1/20 0.40
CYP3A4 P08684 2/20 0.39
ALDH1A1 P00352 3/20 0.36
CA2 P00918 1/20 0.36
POLB P06746 1/20 0.36
TYR P14679 1/20 0.36
GLA P06280 1/20 0.33
MAPT P10636 1/20 0.33
SCN2A Q99250 2/20 0.32
KDM4E B2RXH2 2/20 0.32
S1PR1 P21453 1/20 0.31
KMT2A Q03164 1/20 0.31
USP2 O75604 1/20 0.31

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
SCHEMBL12113657 0.88 HTR1A (0.48) HSPA5HSD17B10HTR1AALDH1A1MAPT
SCHEMBL17565189 0.88 HSPA5 (0.38) HSPA5CYP2C9CYP2C19HIF1ASMN1; SMN2
SCHEMBL17565177 0.81 HTR1A (0.43) HSD17B10HTR1AALDH1A1POLBKDM4E
SCHEMBL17565193 0.79 HTR1A (0.46) SMN1; SMN2CYP2D6HTR1ACYP3A4ALDH1A1
SCHEMBL17565179 0.78 HTR1A (0.41) HSPA5CYP2C9CYP2C19HIF1ASMN1; SMN2
SCHEMBL17565188 0.76 HTR1A (0.37) HSPA5CYP2C9CYP2C19HIF1ASMN1; SMN2
SCHEMBL3398525 0.76 HTR1A (0.58) HSD17B10HTR1AALDH1A1GLAMAPT
SCHEMBL9564329 0.72 HSPA5 (0.71) HSPA5CYP2C9CYP2C19HIF1ASMN1; SMN2
SCHEMBL17565202 0.72 KDM4E (0.42) SMN1; SMN2CYP2D6HTR1AALDH1A1POLB
SCHEMBL17565185 0.72 KDM4E (0.40) SMN1; SMN2HTR1AMAPTKDM4EKMT2A

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-20160071992-A1 BACK SHEET FOR SOLAR CELLS AND SOLAR CELL MODULE FUJIFILM CORPORATION (JP) 2016-03-10 US disclosed