SCHEMBL8380332

SCHEMBL8380332

O=CNc1ncccc1O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 11/20 0.45
NPC1 O15118 10/20 0.45
TSHR P16473 2/20 0.45
NR0B1 P51843 1/20 0.43
L3MBTL1 Q9Y468 3/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ATM Q13315 1/20 0.42
ERN1 O75460 2/20 0.40
KDM4E B2RXH2 2/20 0.40
HSP90AA1 P07900 1/20 0.40
IDO1 P14902 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
ALDH1A1 P00352 2/20 0.39
MMP2 P08253 1/20 0.39
CHRM1 P11229 1/20 0.39
COMT P21964 1/20 0.39
ADRA1A P35348 1/20 0.39
METAP2 P50579 1/20 0.39
METAP1 P53582 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
SCHEMBL2308076 0.78 TSHR (0.39) TSHRMEN1KMT2AKDM4EALDH1A1
SCHEMBL11768825 0.77 MAPT (0.47) RAB9ANPC1TSHRNR0B1L3MBTL1
SCHEMBL26461778 0.76 TRIM24 (0.42) KMT2AKDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL9209140 0.76 CA12 (0.46) L3MBTL1MEN1KMT2AKDM4EHSP90AA1
SCHEMBL4857851 0.76 MAPT (0.53) RAB9ANPC1L3MBTL1KMT2AATM
SCHEMBL9801015 0.76 MAPT (0.53) RAB9ANPC1L3MBTL1KMT2AATM
SCHEMBL15209522 0.76 ALDH1A1 (0.47) RAB9ANPC1MEN1KMT2AKDM4E
SCHEMBL5010673 0.76 DHODH (0.60) RAB9ANPC1TSHRL3MBTL1MEN1
SCHEMBL13430622 0.74 KMT2A (0.43) RAB9ANPC1L3MBTL1MEN1KMT2A
SCHEMBL28236574 0.73 KDM4E (0.48) TSHRL3MBTL1ERN1KDM4EHSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0796297-B1 METHINE DYES BASED ONE FORMYLAMINOPYRIDONES BASF AG (DE) 1999-04-07 EP disclosed
US-5849361-A Methine dyes based on formylaminopyridones BASF AKTIENGESELLSCHAFT (DE) 1998-12-15 US disclosed
EP-0796297-A1 METHINE DYES BASED ONE FORMYLAMINOPYRIDONES BASF AKTIENGESELLSCHAFT (DE) 1997-09-24 EP disclosed
WO-1996017892-A1 METHINE DYES BASED ONE FORMYLAMINOPYRIDONES BASF AKTIENGESELLSCHAFT (DE) 1996-06-13 WO disclosed
EP-0107930-B1 FUSED AROMATIC OXAZEPINONES AND SULPHUR ANALOGUES THEREOF AND THEIR PREPARATION AND USE IN COUNTERACTING HISTAMINE A.H. ROBINS COMPANY, INCORPORATED (a Delaware corporation) (US) 1990-11-28 EP disclosed
US-4812565-A ANTIHISTAMINE INTERMEDIATES A. H. ROBINS COMPANY, INCORPORATED (US) 1989-03-14 US disclosed
US-4810795-A ANTIHISTAMINES A. H. ROBINS COMPANY, INCORPORATED (US) 1989-03-07 US disclosed
US-4727152-A Intermediates useful in the preparation of fused aromatic oxazepinones, thiazepinones, diazepinones and sulfur analogs thereof A. H. ROBINS COMPANY, INC. (US) 1988-02-23 US disclosed
US-4705853-A ANTIHISTAMINES A. H. ROBINS COMPANY, INC. (US) 1987-11-10 US disclosed
US-4642343-A ANTIHISTAMINES A. H. ROBINS COMPANY, INCORPORATED (US) 1987-02-10 US disclosed
US-4604388-A Fused aromatic oxazepinones, thiazepinones, diazepinones and sulfur analogs thereof in a method of counteracting histamine A. H. ROBINS COMPANY, INCORPORATED (US) 1986-08-05 US disclosed
US-4592866-A Fused aromatic oxazepinones, thiazepinones, diazepinones and sulfur analogs thereof A. H. ROBINS COMPANY, INC. (US) 1986-06-03 US disclosed
EP-0107930-A2 Fused aromatic oxazepinones and sulphur analogues thereof and their preparation and use in counteracting histamine A.H. ROBINS COMPANY, INCORPORATED (a Delaware corporation) (US) 1984-05-09 EP disclosed