SCHEMBL11255982

SCHEMBL11255982

CCC1(c2ccccc2)NC(=O)OC1=O

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 3/20 0.53
TSHR P16473 2/20 0.53
LMNA P02545 2/20 0.46
TDP1 Q9NUW8 2/20 0.40
MEN1 O00255 1/20 0.40
CYP1A2 P05177 1/20 0.40
POLB P06746 1/20 0.40
APEX1 P27695 1/20 0.40
KMT2A Q03164 1/20 0.40
ADAM17 P78536 1/20 0.38
FPR2 P25090 1/20 0.38

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
SCHEMBL11259539 0.82 CYP2C19 (0.39) CYP2C19TSHRLMNAMEN1KMT2A
SCHEMBL28873103 0.75 CYP2C19 (0.39) CYP2C19TSHRLMNAKMT2A
SCHEMBL11263469 0.72 CYP2C9 (0.48) LMNATDP1POLB
SCHEMBL2191989 0.71 ADAM17 (0.62) CYP2C19TSHRLMNAADAM17
SCHEMBL3400918 0.71 ADAM17 (0.62) CYP2C19TSHRLMNAADAM17
SCHEMBL4123231 0.71 ADAM17 (0.62) CYP2C19TSHRLMNAADAM17
Mephenytoin SCHEMBL21768 0.69 CYP2C19 (1.00) CYP2C19TSHRLMNATDP1MEN1
Mephenytoin SCHEMBL21766 0.69 CYP2C19 (1.00) CYP2C19TSHRLMNATDP1MEN1
SCHEMBL27951965 0.68 KMT2A (0.55) CYP2C19TSHRLMNATDP1MEN1
SCHEMBL28873111 0.68 CYP2C19 (0.35) CYP2C19TSHRLMNAMEN1KMT2A

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-4314023-A AZO-METHINE DYES KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1982-02-02 US disclosed