SCHEMBL7423903

SCHEMBL7423903

Cc1cc(C)c(NC(=O)CN2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)c(C)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.60
MEN1 O00255 5/20 0.58
KMT2A Q03164 5/20 0.58
POLB P06746 1/20 0.58
CA1 P00915 2/20 0.58
CA2 P00918 2/20 0.58
CA7 P43166 2/20 0.58
LMNA P02545 3/20 0.57
MLNR O43193 1/20 0.57
NR1I2 O75469 1/20 0.57
USP2 O75604 1/20 0.57
CYP1A2 P05177 1/20 0.57
PGR P06401 1/20 0.57
ADRB1 P08588 1/20 0.57
CYP3A4 P08684 1/20 0.57
ADRA2A P08913 1/20 0.57
ADORA3 P0DMS8 1/20 0.57
CYP2D6 P10635 1/20 0.57
CYP2C9 P11712 1/20 0.57
DRD2 P14416 1/20 0.57

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
SCHEMBL7425235 0.85 SLC6A9 (0.57) ALOX15MEN1KMT2APOLBCA1
Hydrochloric Acid SCHEMBL7423643 0.84 SLC6A9 (0.56) ALOX15MEN1KMT2APOLBCA1
SCHEMBL7429713 0.84 SLC6A9 (0.51) ALOX15MEN1KMT2APOLBCA1
Hydrochloric Acid SCHEMBL7437310 0.83 SLC6A9 (0.50) ALOX15MEN1KMT2APOLBCA1
SCHEMBL7430239 0.78 CA1 (0.65) MEN1KMT2APOLBCA1CA2
Hydrochloric Acid SCHEMBL7432666 0.77 CA1 (0.64) MEN1KMT2APOLBCA1CA2
SCHEMBL3391968 0.76 KDM4E (0.60) MEN1KMT2ACA1CA2CA7
SCHEMBL7438110 0.75 POLB (0.74) ALOX15MEN1KMT2APOLBLMNA
SCHEMBL3390183 0.74 MMP2 (0.65) KMT2APOLBCA1CA2CA7
SCHEMBL79038 0.74 MEN1 (0.88) ALOX15MEN1KMT2ALMNAMLNR

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 6 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 claimed
US-5028610-A Calcium Channel Blockers SANKYO COMPANY LIMITED (JP) 1991-07-02 US claimed
EP-0283310-A1 N-Benzhydryl-substituted heterocyclic derivatives, their preparation and their use Sankyo Company Limited (JP) 1988-09-21 EP claimed
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