SCHEMBL24578161

SCHEMBL24578161

CC(=O)c1cnn2cc(-c3cnn(C)c3C)sc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 4/20 0.36
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ NPC1 O15118 3/20 0.36
▸ ALDH1A1 P00352 6/20 0.35
▸ KDM4E B2RXH2 5/20 0.35
▸ MAPT P10636 4/20 0.34
▸ HPGD P15428 2/20 0.34
▸ POLB P06746 2/20 0.34
▸ MAPK1 P28482 2/20 0.34
▸ TDP1 Q9NUW8 1/20 0.33
▸ GAA P10253 2/20 0.33
▸ APOBEC3A P31941 1/20 0.33
▸ MKNK1 Q9BUB5 1/20 0.32
▸ MKNK2 Q9HBH9 1/20 0.32
▸ LMNA P02545 2/20 0.32
▸ TP53 P04637 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ CREBBP Q92793 1/20 0.32
▸ CYP11B2 P19099 1/20 0.31

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
SCHEMBL24577706 0.90 KDM4E (0.43) RAB9ASMN1; SMN2NPC1ALDH1A1KDM4E
SCHEMBL24577223 0.84 MAPT (0.40) RAB9ASMN1; SMN2NPC1ALDH1A1KDM4E
SCHEMBL24577224 0.80 CYP11B2 (0.36) CREBBPCYP11B2
SCHEMBL24577763 0.76 JAK2 (0.35) RAB9ASMN1; SMN2NPC1
SCHEMBL24576968 0.76 BRD4 (0.41) MKNK1MKNK2
SCHEMBL24578329 0.75 MAPT (0.30) MAPTHPGD
SCHEMBL24578258 0.73 HTT (0.33) RAB9ASMN1; SMN2NPC1ALDH1A1MAPT
SCHEMBL24577570 0.72 CCNT1 (0.36) —
SCHEMBL24578202 0.72 CDC7 (0.35) MAPTHPGD
SCHEMBL24578249 0.71 KDM4E (0.43) RAB9ASMN1; SMN2NPC1ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022136509-A1 PYRAZOLOTHIAZOLE CARBOXAMIDES AND THEIR USES AS PDGFR INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2022-06-30 — — WO disclosed
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