SCHEMBL8963723

SCHEMBL8963723

Cc1[nH]c(-c2ccccc2)nc1C(=O)CN1CCN(C(c2ccccc2)c2ccccc2)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIN1 Q13526 1/20 0.51
CACNA2D1 P54289 2/20 0.47
CACNA1B Q00975 2/20 0.47
CACNB1 Q02641 2/20 0.47
CACNA1C Q13936 2/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
ALDH1A1 P00352 2/20 0.47
POLB P06746 1/20 0.47
NPSR1 Q6W5P4 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
LMNA P02545 1/20 0.45
GAA P10253 1/20 0.45
HTT P42858 1/20 0.45
PKM P14618 1/20 0.45
CACNA1G O43497 1/20 0.45
ATM Q13315 1/20 0.44
KDM4E B2RXH2 2/20 0.44
SLC9A1 P19634 1/20 0.44
P2RX7 Q99572 2/20 0.43

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
SCHEMBL8963668 0.78 DRD2 (0.64) MEN1KMT2ANPSR1SMN1; SMN2LMNA
Hydrochloric Acid SCHEMBL8963646 0.76 KMT2A (0.56) MEN1KMT2AALDH1A1NPSR1LMNA
SCHEMBL10679315 0.75 MAPT (0.46) PIN1MEN1KMT2AALDH1A1HTT
SCHEMBL9146587 0.74 LMNA (0.51) MEN1KMT2ANPSR1SMN1; SMN2LMNA
Lifarizine SCHEMBL9494261 0.74 CYP3A4 (0.50) CACNA2D1CACNA1BCACNB1CACNA1CMEN1
Lifarizine SCHEMBL676318 0.73 DRD2 (0.57) MEN1KMT2AALDH1A1NPSR1SMN1; SMN2
SCHEMBL8963931 0.73 CYP2D6 (0.44) PIN1MEN1KMT2AALDH1A1NPSR1
SCHEMBL8963974 0.72 DRD3 (0.59) MEN1KMT2AALDH1A1NPSR1SMN1; SMN2
SCHEMBL8963644 0.72 DRD3 (0.56) MEN1KMT2AALDH1A1NPSR1SMN1; SMN2
Lifarizine SCHEMBL8963776 0.72 DRD2 (0.56) MEN1KMT2AALDH1A1NPSR1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5514800-A CALCIUM CHANNEL BLOCKERS, CEREBRAL ISCHEMIA SYNTEX PHARMACEUTICALS, LTD. (GB) 1996-05-07 US disclosed
US-5276034-A Cardiovascular disorders, nervous system disorders, diuretics, antiischemic agents or antispasmodic agents SYNTEX PHARMACEUTICAL LTD. (GB) 1994-01-04 US disclosed
US-5252736-A Calcium channel antagonists SYNTEX PHARMACEUTICALS, LTD. (GB) 1993-10-12 US disclosed
EP-0289227-B1 SUBSTITUTED IMIDAZOLYL-ALKYL-PIPERAZINE AND -DIAZEPINE DERIVATIVES SYNTEX PHARMACEUTICALS LTD. (GB) 1992-04-08 EP disclosed
US-5091428-A Calcium channel blockers preferential for cerebral blood vessels SYNTEX PHARMACEUTICALS, LTD. (BM) 1992-02-25 US disclosed
US-5043447-A Substituted imidazolyl-alkyl-piperazine and -diazepine derivatives SYNTEX PHARMACEUTICALS, LTD. (GB) 1991-08-27 US disclosed
US-5010075-A Antiepilepic, hypotensive, antiarrhythmia, antiischemic agent SYNTEX PHARMACEUTICALS LTD. (GB) 1991-04-23 US disclosed
US-4935417-A CALCIUM CHANNEL BLOCKERS SYNTEX PHARMACEUTICALS LTD. (BM) 1990-06-19 US disclosed
US-4829065-A Substituted imidazolyl-alkyl-piperazine and -diazepine derivatives SYNTEX PHARMACEUTICALS, LTD. (GB) 1989-05-09 US disclosed
EP-0289227-A1 Substituted imidazolyl-alkyl-piperazine and -diazepine derivatives SYNTEX PHARMACEUTICALS LTD. (GB) 1988-11-02 EP disclosed