Sugi Predict

Sugi Predict / Compounds / SCHEMBL9687727

SCHEMBL9687727

SCHEMBL9687727

CN(C)c1cccc(C(=O)NCCc2c3n(c4ccccc24)C(=O)CCC3)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 1/20 0.46
▸ POLB P06746 3/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ SMN1; SMN2 Q16637 4/20 0.46
▸ GFER P55789 3/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ MAPT P10636 1/20 0.46
▸ NPC1 O15118 4/20 0.44
▸ RAB9A P51151 4/20 0.44
▸ TSHR P16473 2/20 0.44
▸ GAA P10253 1/20 0.44
▸ KDM4E B2RXH2 5/20 0.43
▸ HSD17B10 Q99714 2/20 0.43
▸ TP53 P04637 2/20 0.43
▸ TMEM97 Q5BJF2 1/20 0.43
▸ SIGMAR1 Q99720 1/20 0.43
▸ LMNA P02545 1/20 0.41
▸ HDAC3 O15379 1/20 0.40
▸ HDAC1 Q13547 1/20 0.40
▸ MEN1 O00255 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
SCHEMBL10572796 0.90 ALDH1A1 (0.43) NAMPTPOLBKMT2ASMN1; SMN2GFER
SCHEMBL9687710 0.90 NPC1 (0.42) NAMPTPOLBKMT2ASMN1; SMN2GFER
Hydrochloric Acid SCHEMBL10574395 0.90 ALDH1A1 (0.42) NAMPTPOLBKMT2ASMN1; SMN2GFER
SCHEMBL9687497 0.90 NAMPT (0.43) NAMPTKMT2AALDH1A1MAPTTSHR
SCHEMBL9688855 0.86 RAB9A (0.47) KMT2ASMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL9687548 0.86 NPC1 (0.48) POLBKMT2ASMN1; SMN2GFERALDH1A1
Hydrochloric Acid SCHEMBL10377827 0.85 NPC1 (0.48) POLBKMT2ASMN1; SMN2GFERALDH1A1
SCHEMBL10377756 0.84 NPC1 (0.48) POLBALDH1A1MAPTNPC1RAB9A
SCHEMBL9688571 0.84 NPC1 (0.52) POLBKMT2ASMN1; SMN2GFERALDH1A1
SCHEMBL9689157 0.83 NPC1 (0.51) POLBKMT2ASMN1; SMN2GFERALDH1A1

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
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
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 disclosed
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