SCHEMBL9313245

SCHEMBL9313245

C=COC(=O)c1ccc(Cl)cc1Cl

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.53
TSHR P16473 1/20 0.53
CASP1 P29466 1/20 0.53
HPGD P15428 5/20 0.51
POLB P06746 1/20 0.51
MAPT P10636 7/20 0.49
RAB9A P51151 6/20 0.49
NPC1 O15118 5/20 0.49
KMT2A Q03164 3/20 0.49
GAA P10253 1/20 0.49
CASP3 P42574 1/20 0.49
SENP7 Q9BQF6 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
ALDH1A1 P00352 3/20 0.49
MAPK1 P28482 1/20 0.49
HIF1A Q16665 1/20 0.49
KDM4E B2RXH2 1/20 0.47
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46

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
SCHEMBL5754026 0.84 SMN1; SMN2 (0.55) SMN1; SMN2TSHRCASP1HPGDPOLB
SCHEMBL6971123 0.79 SMN1; SMN2 (0.59) SMN1; SMN2TSHRCASP1HPGDPOLB
SCHEMBL1349424 0.79 SMN1; SMN2 (0.59) SMN1; SMN2TSHRCASP1HPGDPOLB
SCHEMBL1501319 0.79 SMN1; SMN2 (0.63) SMN1; SMN2TSHRCASP1HPGDMAPT
SCHEMBL15385 0.79 SMN1; SMN2 (0.63) SMN1; SMN2TSHRCASP1HPGDMAPT
SCHEMBL4975483 0.78 CYP3A4 (0.57) SMN1; SMN2TSHRCASP1HPGDPOLB
SCHEMBL194413 0.78 CES2 (0.52) SMN1; SMN2HPGDPOLBMAPTRAB9A
SCHEMBL10715347 0.77 SMN1; SMN2 (0.61) SMN1; SMN2TSHRCASP1HPGDMAPT
SCHEMBL669388 0.77 SMN1; SMN2 (0.61) SMN1; SMN2TSHRCASP1HPGDMAPT
SCHEMBL608814 0.76 ABL1 (0.68) SMN1; SMN2TSHRCASP1HPGDPOLB

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-5294484-A Multilayer element SONY CORPORATION (JP) 1994-03-15 US disclosed
US-4123275-A A VINYL ESTER WITH A HYDROXYALKYL ACRYLATE OR METHACRYLATE, ACRYLAMIDES, METHACRYLAMIDES OR A VINYL HETEROCYCLE FUJI PHOTO FILM CO., LTD. (JP) 1978-10-31 US disclosed