SCHEMBL9689157

SCHEMBL9689157

O=C(NCCc1c2n(c3ccccc13)C(=O)CCC2)c1cccc(N2CCCCC2)c1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.51
RAB9A P51151 5/20 0.51
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
HPGD P15428 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
USP2 O75604 2/20 0.43
GAA P10253 3/20 0.42
POLB P06746 2/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
ALDH1A1 P00352 3/20 0.42
GFER P55789 2/20 0.42
MAPT P10636 2/20 0.42
TSHR P16473 2/20 0.42
HSD17B10 Q99714 2/20 0.40
KDM4E B2RXH2 1/20 0.40
PRMT5 O14744 1/20 0.39
CNR1 P21554 1/20 0.39
CNR2 P34972 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
SCHEMBL9688571 0.99 NPC1 (0.52) NPC1RAB9AMEN1KMT2AHPGD
SCHEMBL9687548 0.88 NPC1 (0.48) NPC1RAB9AMEN1KMT2AHPGD
Hydrochloric Acid SCHEMBL10377827 0.87 NPC1 (0.48) NPC1RAB9AMEN1KMT2AHPGD
SCHEMBL9688855 0.86 RAB9A (0.47) NPC1RAB9AMEN1KMT2AHPGD
SCHEMBL9687727 0.83 NAMPT (0.46) NPC1RAB9AMEN1KMT2AHPGD
SCHEMBL10377571 0.83 NPC1 (0.43) NPC1RAB9AMEN1KMT2AHPGD
SCHEMBL9687884 0.83 ALDH1A1 (0.53) NPC1RAB9AMEN1KMT2AHPGD
SCHEMBL10377756 0.83 NPC1 (0.48) NPC1RAB9AUSP2GAAPOLB
SCHEMBL9687710 0.81 NPC1 (0.42) NPC1RAB9AMEN1KMT2AHPGD
SCHEMBL10377807 0.80 NPC1 (0.42) NPC1RAB9AMEN1KMT2AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0279125-B1 TETRAHYDROPYRIDO(1,2-A)INDOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM BEECHAM - WUELFING GmbH & Co. KG (DE) 1992-04-29 EP claimed
EP-0167901-B1 ACTIVE COMPOUNDS LES LABORATOIRES BEECHAM S.A. (FR) 1990-04-04 EP claimed
EP-0279125-A1 Tetrahydropyrido(1,2-a)indole derivatives, process for their preparation and pharmaceutical compositions containing them BEECHAM - WUELFING GmbH & Co. KG (DE) 1988-08-24 EP claimed
EP-0167901-A2 Active compounds LES LABORATOIRES BEECHAM S.A. (FR) 1986-01-15 EP claimed
US-4968699-A CENTRAL NERVOUS SYSTEM; ANTIISCHEMIC AND ANTIHYPOXIC AGENTS; ACTIVE AGAINST CEREBRAL OXYGEN DEFICIENCY BEECHAM-WUELFING GMBH & CO. (DE) 1990-11-06 US disclosed
EP-0167901-B1 ACTIVE COMPOUNDS LES LABORATOIRES BEECHAM S.A. (FR) 1990-04-04 EP disclosed
US-4853391-A Pyrido[1,2-a]indoles and their use as cardiovascular LABORATOIRES SOBIO SA, 13-15-25 BOULEVARD DE 1'AMIRAL BRUIX 75782 PARIS, CEDEX 16, FRANCE 1989-08-01 US disclosed
EP-0279125-A1 Tetrahydropyrido(1,2-a)indole derivatives, process for their preparation and pharmaceutical compositions containing them BEECHAM - WUELFING GmbH & Co. KG (DE) 1988-08-24 EP disclosed
EP-0167901-A2 Active compounds LES LABORATOIRES BEECHAM S.A. (FR) 1986-01-15 EP disclosed