SCHEMBL5269564

SCHEMBL5269564

Clc1nc(Cl)c2cc(-c3ccccc3)sc2n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.53
ADORA1 P30542 1/20 0.53
RAB9A P51151 13/20 0.50
ALDH1A1 P00352 13/20 0.50
NPC1 O15118 11/20 0.50
SMN1; SMN2 Q16637 10/20 0.50
KDM4E B2RXH2 8/20 0.50
MAPT P10636 6/20 0.50
GAA P10253 3/20 0.50
PKM P14618 1/20 0.50
RXFP1 Q9HBX9 2/20 0.45
PPARG P37231 1/20 0.45
NCOA2 Q15596 1/20 0.45
NCOA1 Q15788 1/20 0.45
LMNA P02545 3/20 0.45
TSHR P16473 3/20 0.45
HTT P42858 2/20 0.45
ALOX15 P16050 1/20 0.45
HSD17B10 Q99714 1/20 0.45
HPGD P15428 3/20 0.44

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
SCHEMBL16652412 0.85 ALDH1A1 (0.58) ADORA2AADORA1RAB9AALDH1A1NPC1
SCHEMBL19439400 0.85 ADORA2A (0.51) ADORA2AADORA1RAB9AALDH1A1NPC1
SCHEMBL20659883 0.80 ALDH1A1 (0.48) ADORA2AADORA1RAB9AALDH1A1NPC1
SCHEMBL2977154 0.77 ALDH1A1 (0.61) RAB9AALDH1A1NPC1SMN1; SMN2KDM4E
SCHEMBL14034101 0.74 ALDH1A1 (0.74) RAB9AALDH1A1NPC1SMN1; SMN2KDM4E
SCHEMBL5120193 0.72 SELE (0.31)
SCHEMBL654609 0.72 FGFR1 (0.47) ADORA2AADORA1RAB9AALDH1A1NPC1
SCHEMBL16776797 0.70 ADORA2A (0.53) ADORA2AADORA1RAB9AALDH1A1NPC1
SCHEMBL23599111 0.69
SCHEMBL1969445 0.69 KDM4E (0.36) ALDH1A1KDM4EMAPTKMT2AMEN1

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
EP-1844052-A1 THIENO[2,3-D]PYRIMIDINE COMPOUNDS AS INHIBITORS OF ADP-MEDIATED PLATELETS AGGREGATION Pharmacia & Upjohn Company LLC (US) 2007-10-17 EP disclosed
WO-2006079916-A1 THIENO [2,3-D] PYRIMIDINE COMPOUNDS AS INHIBITORS OF ADP-MEDIATED PLATELETS AGGREGATION PHARMACIA & UPJOHN COMPANY LLC (US) 2006-08-03 WO disclosed