SCHEMBL7815277

SCHEMBL7815277

NC1=C(S)C(=O)c2ccccc2C1=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.56
RAB9A P51151 5/20 0.56
POLB P06746 4/20 0.56
ALDH1A1 P00352 4/20 0.56
NSD2 O96028 3/20 0.56
MAPT P10636 2/20 0.56
MEN1 O00255 5/20 0.50
KMT2A Q03164 5/20 0.50
CDC25B P30305 1/20 0.50
ADORA2A P29274 4/20 0.48
MAOA P21397 3/20 0.48
CSNK1A1 P48729 2/20 0.48
CSNK1D P48730 2/20 0.48
CSNK1G1 Q9HCP0 2/20 0.48
FGR P09769 1/20 0.48
PIM1 P11309 1/20 0.48
DYRK1A Q13627 1/20 0.48
HIPK2 Q9H2X6 1/20 0.48
PTPRC P08575 4/20 0.48
SMN1; SMN2 Q16637 4/20 0.48

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
SCHEMBL29563346 0.82 RAB9A (0.68) NPC1RAB9APOLBALDH1A1NSD2
SCHEMBL1510327 0.82 RAB9A (0.68) NPC1RAB9APOLBALDH1A1NSD2
SCHEMBL28227189 0.82 CDC25B (0.65) NPC1RAB9APOLBALDH1A1MAPT
SCHEMBL27587283 0.79 CDC25B (0.61) NPC1RAB9APOLBALDH1A1MAPT
SCHEMBL16745451 0.75 RAB9A (0.60) NPC1RAB9APOLBALDH1A1NSD2
Anthraquinone SCHEMBL10771377 0.73 MEN1 (0.92) NPC1RAB9APOLBALDH1A1MAPT
SCHEMBL14660371 0.71 ALDH1A1 (1.00) NPC1RAB9APOLBALDH1A1NSD2
SCHEMBL14662957 0.71 NPC1 (0.56) NPC1RAB9APOLBALDH1A1NSD2
SCHEMBL21141273 0.71 CDC25B (0.56) NPC1RAB9APOLBALDH1A1MAPT
SCHEMBL21141483 0.71 IDO1 (0.68) NPC1RAB9APOLBALDH1A1NSD2

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
JP-61251675-A None JP disclosed
CN-1440966-A Naphthaquinone thiazole as organic as third-order non-linear optical material and its chemical synthesis process UNIV ZHEJIANG POLYTECHNIC (CN) 2003-09-10 CN disclosed
EP-0876356-B1 USE OF TRICYCLIC 1,4-DIHYDRO-1,4-DIOXO-1H-NAPHTHALENE DERIVATIVES, RESULTING NOVEL COMPOUNDS AND THERAPEUTICAL USE THEREOF INNOTHERA SA LAB (FR) 2001-10-31 EP disclosed
US-6262095-B1 TREATMENT OF ILLNESS ASSOCIATED WITH AN ALTERATION IN VENOUS FUNCTION AND/OR INFLAMMATORY EDEMA LABORATOIRE INNOTHERA (FR) 2001-07-17 US disclosed
WO-1998037076-A1 METHOD FOR INDUSTRIAL PRODUCTION OF NAPHTO-[2,3-D]-THIAZOLE COMPOUNDS INNOKEM, S.A.R.L. (FR) 1998-08-27 WO disclosed
JP-S61251675-A PRODUCTION OF NAPHTHO(2.3-D)THIAZOLE-4,9-DIONE COMPOUND KAWASAKI KASEI CHEM LTD 1986-11-08 JP disclosed