SCHEMBL24577232

SCHEMBL24577232

CCOC(=O)c1cnn2cc(-n3ncc4cccnc43)sc12

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.45
TGFBR1 P36897 3/20 0.45
RAB9A P51151 2/20 0.45
NPC1 O15118 1/20 0.45
TP53 P04637 1/20 0.45
MAPT P10636 2/20 0.44
ELANE P08246 4/20 0.43
ALDH1A1 P00352 6/20 0.41
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.39
HSD17B10 Q99714 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
DCTPP1 Q9H773 1/20 0.39
TSHR P16473 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL24578555 0.84 KDM4E (0.46) TGFBR1ALDH1A1KDM4EHTT
SCHEMBL29759525 0.83 KDM4E (0.42) TGFBR1RAB9AKDM4ELMNASMN1; SMN2
SCHEMBL29759760 0.77 LMNA (0.42) LMNA
SCHEMBL24578412 0.77 LMNA (0.42) LMNA
SCHEMBL24577809 0.76 TGFBR1 (0.43) HPGDTGFBR1RAB9ANPC1TP53
Hydrochloric Acid SCHEMBL30566615 0.76 TGFBR1 (0.42) HPGDTGFBR1RAB9ANPC1TP53
Hydrochloric Acid SCHEMBL29759531 0.76 TGFBR1 (0.42) HPGDTGFBR1RAB9ANPC1TP53
SCHEMBL24579001 0.75 IRAK4 (0.39) LMNA
SCHEMBL29760131 0.75 IRAK4 (0.39) LMNA
SCHEMBL29759559 0.75 TGFBR1 (0.42) HPGDTGFBR1RAB9ANPC1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4267585-A1 PYRAZOLOTHIAZOLE CARBOXAMIDES AND THEIR USES AS PDGFR INHIBITORS Actelion Pharmaceuticals Ltd (CH) 2023-11-01 EP disclosed
CN-116802184-A Pyrazolothiazole carboxamides and their use as PDGFR inhibitors 埃科特莱茵药品有限公司 2023-09-22 CN disclosed
WO-2022136509-A1 PYRAZOLOTHIAZOLE CARBOXAMIDES AND THEIR USES AS PDGFR INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2022-06-30 WO disclosed
WO-2022136509-A1 PYRAZOLOTHIAZOLE CARBOXAMIDES AND THEIR USES AS PDGFR INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2022-06-30 WO disclosed