SCHEMBL9615367

SCHEMBL9615367

Cc1cccc(C(C)c2ccc(C)c(C(=O)O)c2O)c1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.41
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CYP3A4 P08684 4/20 0.40
CYP2C9 P11712 3/20 0.40
TDP1 Q9NUW8 2/20 0.40
KMT2A Q03164 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ADRA2A P08913 4/20 0.37
ADRA2B P18089 4/20 0.37
ADRA2C P18825 4/20 0.37
ADRA1A P35348 3/20 0.37
ADRA1B P35368 3/20 0.37
TSHR P16473 3/20 0.37
CYP1A2 P05177 3/20 0.37
ADRA1D P25100 2/20 0.37
KCNH2 Q12809 1/20 0.37
TP53 P04637 1/20 0.37
CYP2D6 P10635 1/20 0.37

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
SCHEMBL9615365 0.89 CYP3A4 (0.41) HPGDALDH1A1KDM4EHSD17B10CYP3A4
SCHEMBL1129856 0.81 TYR (0.46) HPGDALDH1A1KDM4EHSD17B10CYP3A4
SCHEMBL9615352 0.81 LDHA (0.50) L3MBTL1LDHALDHB
SCHEMBL9497285 0.80 TYR (0.45) HPGDALDH1A1KDM4EHSD17B10CYP3A4
Orthothymotinic Acid SCHEMBL503619 0.79 LDHA (0.46) HPGDALDH1A1KDM4EHSD17B10CYP3A4
SCHEMBL9325617 0.78 LDHA (0.43) HPGDALDH1A1KDM4EHSD17B10TSHR
SCHEMBL9615364 0.77 LDHA (0.40) ALDH1A1CYP3A4LDHALDHBGAA
Acetone SCHEMBL9668689 0.76 ADRA2A (0.47) HPGDALDH1A1KDM4EHSD17B10CYP3A4
SCHEMBL11301017 0.74 TSHR (0.49) HPGDALDH1A1CYP3A4CYP2C9ADRA2A
SCHEMBL1053969 0.74 TSHR (0.55) HPGDALDH1A1CYP3A4CYP2C9ADRA2A

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