SCHEMBL7433315

SCHEMBL7433315

CC(Br)C(=O)Nc1cccc(F)c1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.61
KMT2A Q03164 7/20 0.61
ATM Q13315 1/20 0.61
KDM4E B2RXH2 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.57
MTOR P42345 1/20 0.55
RAB9A P51151 4/20 0.53
NPC1 O15118 2/20 0.53
HPGD P15428 2/20 0.53
TSHR P16473 1/20 0.53
MAPT P10636 4/20 0.51
GAA P10253 1/20 0.51
ALDH1A1 P00352 2/20 0.51
GFER P55789 1/20 0.50
THRB P10828 1/20 0.49
HTT P42858 1/20 0.49
TDP1 Q9NUW8 1/20 0.49

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
SCHEMBL11310154 0.86 MEN1 (0.64) MEN1KMT2AATMKDM4ESMN1; SMN2
SCHEMBL23975946 0.82 MEN1 (0.59) MEN1KMT2AATMKDM4ESMN1; SMN2
SCHEMBL2125145 0.82 MEN1 (0.63) MEN1KMT2AATMKDM4ESMN1; SMN2
SCHEMBL23975950 0.82 MEN1 (0.59) MEN1KMT2AATMKDM4ESMN1; SMN2
SCHEMBL4820385 0.81 HSD17B10 (0.61) MEN1KMT2ASMN1; SMN2RAB9ANPC1
SCHEMBL4003494 0.81 HSD17B10 (0.61) MEN1KMT2ASMN1; SMN2RAB9ANPC1
SCHEMBL2608526 0.81 MEN1 (0.58) MEN1KMT2AATMKDM4ESMN1; SMN2
SCHEMBL23986784 0.81 MEN1 (0.59) MEN1KMT2AATMKDM4ESMN1; SMN2
Hydrochloric Acid SCHEMBL30225304 0.81 MEN1 (0.58) MEN1KMT2AATMKDM4ESMN1; SMN2
SCHEMBL16738057 0.80 POLB (0.61) MEN1KMT2ASMN1; SMN2RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0283310-B1 N-BENZHYDRYL-SUBSTITUTED HETEROCYCLIC DERIVATIVES, THEIR PREPARATION AND THEIR USE Sankyo Company Limited (JP) 1993-05-26 EP disclosed
US-5028610-A Calcium Channel Blockers SANKYO COMPANY LIMITED (JP) 1991-07-02 US disclosed
EP-0283310-A1 N-Benzhydryl-substituted heterocyclic derivatives, their preparation and their use Sankyo Company Limited (JP) 1988-09-21 EP disclosed