SCHEMBL9615364

SCHEMBL9615364

Cc1ccc(C(C)c2ccc(C)c(C(=O)O)c2O)cc1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LDHA P00338 4/20 0.40
LDHB P07195 4/20 0.40
ALB P02768 3/20 0.40
RXRA P19793 1/20 0.38
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
FABP3 P05413 1/20 0.35
FABP4 P15090 1/20 0.35
ACHE P22303 1/20 0.35
ALOX5 P09917 1/20 0.35
TYR P14679 1/20 0.35
AKR1C2 P52895 1/20 0.35
AKR1C1 Q04828 1/20 0.35
CYP3A4 P08684 1/20 0.34
MAPT P10636 1/20 0.34
SRD5A2 P31213 1/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
HTT P42858 1/20 0.33

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
SCHEMBL1129856 0.89 TYR (0.46) LDHALDHBRXRAALDH1A1FABP3
SCHEMBL9497285 0.88 TYR (0.45) LDHALDHBRXRAALDH1A1FABP3
SCHEMBL9325617 0.82 LDHA (0.43) LDHALDHBALBALDH1A1FABP3
Orthothymotinic Acid SCHEMBL503619 0.80 LDHA (0.46) LDHALDHBALBALDH1A1FABP3
SCHEMBL9615365 0.78 CYP3A4 (0.41) LDHALDHBALBALDH1A1CYP3A4
SCHEMBL9615367 0.77 HPGD (0.41) LDHALDHBALDH1A1AKR1C2AKR1C1
Zinc Ion SCHEMBL9497278 0.76 TYR (0.43) ALOX5TYRCYP3A4LMNAGAA
SCHEMBL10487156 0.76 TYR (0.49) ALDH1A1FABP3FABP4ALOX5TYR
SCHEMBL8377743 0.72 AKR1C2 (0.48) LDHALDHBALBRXRAALDH1A1
SCHEMBL31643742 0.71 ALDH1A1 (0.50) LDHALDHBALBALDH1A1ACHE

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-5128309-A Recording material FUJI PHOTO FILM CO., LTD. (JP) 1992-07-07 US disclosed