SCHEMBL9764294

SCHEMBL9764294

Cn1c(C=CCO)c(-c2ccccc2)c2ccccc2c1=O

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 11/20 0.44
LMNA P02545 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
BRD4 O60885 1/20 0.42
KDM4E B2RXH2 2/20 0.40
GAA P10253 1/20 0.40
DPP4 P27487 3/20 0.40
RCE1 Q9Y256 1/20 0.40
MAPK8 P45983 1/20 0.39
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL9764285 1.00 TACR1 (0.44) TACR1LMNAKMT2ASMN1; SMN2BRD4
SCHEMBL9763860 0.82 TACR1 (0.47) TACR1LMNAKMT2ASMN1; SMN2MAPK8
SCHEMBL9763854 0.82 TACR1 (0.47) TACR1LMNAKMT2ASMN1; SMN2MAPK8
SCHEMBL9763884 0.80 TACR1 (0.43) TACR1LMNAKMT2ASMN1; SMN2BRD4
SCHEMBL9763878 0.80 TACR1 (0.43) TACR1LMNAKMT2ASMN1; SMN2BRD4
SCHEMBL9763435 0.80 TACR1 (0.43) TACR1LMNAKMT2ASMN1; SMN2BRD4
SCHEMBL9763438 0.80 TACR1 (0.43) TACR1LMNAKMT2ASMN1; SMN2BRD4
SCHEMBL9763498 0.79 LMNA (0.46) TACR1LMNAKMT2ASMN1; SMN2BRD4
SCHEMBL8785517 0.75 TACR1 (0.54) TACR1LMNAKMT2ASMN1; SMN2BRD4
SCHEMBL9764218 0.74 CYP2C9 (0.43) TACR1LMNAKMT2ASMN1; SMN2KDM4E

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-5004747-A Isoquinolinones MAY & BAKER LIMITED (GB) 1991-04-02 US disclosed