SCHEMBL11265618

SCHEMBL11265618

Cc1ccc(Nc2nc3ccc(C)cc3s2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 10/20 0.71
RAB9A P51151 10/20 0.71
SMN1; SMN2 Q16637 8/20 0.71
MAPT P10636 7/20 0.71
MEN1 O00255 5/20 0.71
KMT2A Q03164 5/20 0.71
LMNA P02545 2/20 0.59
DYRK1A Q13627 1/20 0.59
NFKB1 P19838 2/20 0.55
NFKB2 Q00653 2/20 0.55
RELA Q04206 2/20 0.55
APP P05067 2/20 0.54
SNCA P37840 1/20 0.54
CSNK1D P48730 1/20 0.52
CSNK1G2 P78368 1/20 0.52
CASP3 P42574 1/20 0.51
SENP8 Q96LD8 1/20 0.51
SENP7 Q9BQF6 1/20 0.51
SENP6 Q9GZR1 1/20 0.51
TP53 P04637 1/20 0.51

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
SCHEMBL1747941 0.91 NPC1 (0.60) NPC1RAB9ASMN1; SMN2MAPTMEN1
SCHEMBL12593865 0.91 NPC1 (0.60) NPC1RAB9ASMN1; SMN2MAPTMEN1
SCHEMBL18236210 0.90 NPC1 (0.68) NPC1RAB9ASMN1; SMN2MAPTMEN1
SCHEMBL27814067 0.88 NPC1 (0.82) NPC1RAB9ASMN1; SMN2MAPTMEN1
SCHEMBL12428584 0.88 NPC1 (0.57) NPC1RAB9ASMN1; SMN2MAPTMEN1
SCHEMBL21914837 0.86 NPC1 (0.62) NPC1RAB9ASMN1; SMN2MAPTMEN1
SCHEMBL2759505 0.85 MAPT (0.86) NPC1RAB9ASMN1; SMN2MAPTMEN1
SCHEMBL1821678 0.83 NPC1 (1.00) NPC1RAB9ASMN1; SMN2MAPTMEN1
SCHEMBL13151088 0.81 NPC1 (0.64) NPC1RAB9ASMN1; SMN2MAPTMEN1
SCHEMBL2115626 0.79 NPC1 (0.65) NPC1RAB9ASMN1; SMN2MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0003141-B1 PROCESS FOR THE PREPARATION OF 2-AMINO-ARYLENOTHIAZOLE COMPOUNDS AND THEIR RING N-SUBSTITUTED DERIVATIVES HOECHST AKTIENGESELLSCHAFT (DE) 1982-07-14 EP disclosed
US-4252963-A CYCLIZATION OF PHENYLTHIOUREAS WITH THIONYL CHLORIDE HOECHST AKTIENGESELLSCHAFT (DE) 1981-02-24 US disclosed
EP-0003141-A2 Process for the preparation of 2-amino-arylenothiazole compounds and their ring N-substituted derivatives HOECHST AKTIENGESELLSCHAFT (DE) 1979-07-25 EP disclosed