SCHEMBL27364542

SCHEMBL27364542

CCc1nccn1OC(=O)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.41
KMT2A Q03164 1/20 0.40
TSHR P16473 4/20 0.40
ALPG P10696 2/20 0.39
PLAA Q9Y263 1/20 0.39
ALPL P05186 1/20 0.39
FDPS P14324 1/20 0.39
F2 P00734 1/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2C19 P33261 2/20 0.38
CYP2D6 P10635 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
MAPK1 P28482 2/20 0.36
CYP2C9 P11712 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HTT P42858 1/20 0.36
PKM P14618 1/20 0.36
HIF1A Q16665 1/20 0.36

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
SCHEMBL28185568 0.80 KMT2A (0.43) LMNAKMT2ATSHRF2L3MBTL1
SCHEMBL28048388 0.74 ALPG (0.36) TSHRALPGPLAAALPLFDPS
SCHEMBL10554675 0.73 TNK2 (0.41) KMT2ATSHRCYP1A2CYP2C19CYP2D6
Benzoic Acid SCHEMBL2518954 0.73 KMT2A (0.50) KMT2ATSHRALPGPLAAALPL
SCHEMBL6259211 0.71 ALDH1A1 (0.40) LMNAKMT2AHTT
SCHEMBL9880601 0.70 ALDH1A1 (0.46) KMT2ATSHRL3MBTL1TDP1MAPK1
SCHEMBL27464997 0.68 TSHR (0.47) LMNAKMT2ATSHRF2CYP2C19
SCHEMBL2804720 0.68 KMT2A (0.52) LMNAKMT2ATSHRF2CYP2D6
SCHEMBL13604014 0.66 LMNA (0.47) LMNAKMT2ATSHRF2TDP1
SCHEMBL27635032 0.66 LMNA (0.47) LMNAKMT2ATSHRF2TDP1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1064042-C Intermediate of benzazepine derivative YAMANOUCHI PHARMA CO LTD (JP) 2001-04-04 CN disclosed
CN-1040748-C Benzazepine derivatives, pharmaceutical compositions and intermediates thereof YAMANOUCHI PHARMA CO LTD (JP) 1998-11-18 CN disclosed
CN-1198437-A Intermediate of benzazepine derivative YAMANOUCHI PHARMA CO LTD (JP) 1998-11-11 CN disclosed
CN-1129934-A Benzazepine derivatives, pharmaceutical compositions and intermediates thereof YAMANOUCHI PHARMA CO LTD (JP) 1996-08-28 CN disclosed