SCHEMBL11117595

SCHEMBL11117595

C#CCOc1nc2ccc(Cl)cc2s1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 2/20 0.47
PTGS2 P35354 2/20 0.47
KMT2A Q03164 3/20 0.44
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
MAPT P10636 2/20 0.44
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.44
ALOX12 P18054 1/20 0.44
HTT P42858 1/20 0.44
HPGD P15428 1/20 0.42
TSHR P16473 1/20 0.42
CASP3 P42574 2/20 0.40
SENP8 Q96LD8 2/20 0.40
SENP7 Q9BQF6 2/20 0.40
SENP6 Q9GZR1 2/20 0.40

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
SCHEMBL11113691 0.88 LOXL2 (0.48) PTGS1PTGS2NPC1RAB9ASMN1; SMN2
SCHEMBL9852614 0.82 GFER (0.47) PTGS1PTGS2KMT2ANPC1RAB9A
SCHEMBL11205335 0.80 KMT2A (0.59) PTGS1PTGS2KMT2ANPC1RAB9A
SCHEMBL20733701 0.79 NPC1 (0.53) PTGS1PTGS2KMT2ANPC1RAB9A
SCHEMBL7074465 0.78 PTGS1 (0.54) PTGS1PTGS2KMT2ANPC1RAB9A
SCHEMBL13071505 0.74 NPC1 (0.51) PTGS1PTGS2KMT2ANPC1RAB9A
SCHEMBL11113555 0.73 PGK1 (0.37) PTGS1PTGS2LMNAHPGDTSHR
SCHEMBL11117152 0.73 MAOB (0.41) PTGS1PTGS2RAB9ASMN1; SMN2MAPT
SCHEMBL10568147 0.73 PTGS1 (0.44) PTGS1PTGS2KMT2ANPC1RAB9A
SCHEMBL19624141 0.71 NPC1 (0.56) KMT2ANPC1RAB9ASMN1; SMN2MAPT

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-0044008-B1 USE OF 2-PROPARGYLOXY-BENZAZOLES AS SYNERGISTS BAYER AG (DE) 1984-12-05 EP disclosed
EP-0044008-A1 Use of 2-propargyloxy-benzazoles as synergists BAYER AG (DE) 1982-01-20 EP disclosed