SCHEMBL10678325

SCHEMBL10678325

CC=NNc1nc2ccc(Cl)cc2s1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 6/20 0.59
▸ RAB9A P51151 6/20 0.59
▸ KDM4E B2RXH2 5/20 0.59
▸ SMN1; SMN2 Q16637 4/20 0.59
▸ MEN1 O00255 3/20 0.59
▸ KMT2A Q03164 3/20 0.59
▸ ALDH1A1 P00352 3/20 0.59
▸ MAPT P10636 2/20 0.59
▸ HTT P42858 2/20 0.59
▸ LMNA P02545 1/20 0.59
▸ GAA P10253 1/20 0.59
▸ ALOX12 P18054 1/20 0.59
▸ DYRK1A Q13627 1/20 0.56
▸ FSCN1 Q16658 1/20 0.56
▸ CASP3 P42574 10/20 0.49
▸ SENP7 Q9BQF6 10/20 0.49
▸ SENP8 Q96LD8 9/20 0.49
▸ SENP6 Q9GZR1 9/20 0.49
▸ PTPN1 P18031 1/20 0.47
▸ HPGD P15428 2/20 0.45

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
SCHEMBL11019331 0.88 IDO1 (0.59) NPC1RAB9AKDM4ESMN1; SMN2MEN1
SCHEMBL10672271 0.84 NPC1 (0.55) NPC1RAB9AKDM4ESMN1; SMN2MEN1
SCHEMBL17123531 0.78 MAPT (0.67) NPC1RAB9AKDM4ESMN1; SMN2MEN1
SCHEMBL11020618 0.78 MAPT (0.67) NPC1RAB9AKDM4ESMN1; SMN2MEN1
SCHEMBL12393158 0.78 MEN1 (0.70) NPC1RAB9AKDM4ESMN1; SMN2MEN1
SCHEMBL24707315 0.76 SMN1; SMN2 (0.55) NPC1RAB9AKDM4ESMN1; SMN2MEN1
SCHEMBL29974383 0.75 NPC1 (0.66) NPC1RAB9AKDM4ESMN1; SMN2MEN1
SCHEMBL28878451 0.75 NPC1 (0.66) NPC1RAB9AKDM4ESMN1; SMN2MEN1
SCHEMBL2116067 0.74 MEN1 (1.00) NPC1RAB9AKDM4ESMN1; SMN2MEN1
SCHEMBL12368479 0.74 NPC1 (0.64) NPC1RAB9AKDM4ESMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4732986-A Benzothiazole derivatives, processes for their preparation and pharmaceutical compositions containing these compounds LUDWIG HEUMANN & CO. GMBH (DE) 1988-03-22 — — US disclosed
EP-0160173-A1 Benzothiazole derivatives, processes for their production and medicaments containing them LUDWIG HEUMANN & CO GMBH (DE) 1985-11-06 — — EP disclosed
Send feedback