SCHEMBL14375915

SCHEMBL14375915

CCn1c(=O)[nH]c2cc(NC(=O)Nc3ccc(CN4CCS(=O)(=O)CC4)cc3)ccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 7/20 0.48
▸ NPC1 O15118 5/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ SMN1; SMN2 Q16637 5/20 0.48
▸ HPGD P15428 3/20 0.48
▸ POLB P06746 2/20 0.48
▸ LMNA P02545 2/20 0.48
▸ L3MBTL1 Q9Y468 2/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ TP53 P04637 3/20 0.47
▸ MAPT P10636 4/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ PKM P14618 1/20 0.46
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ MAPK14 Q16539 2/20 0.44
▸ ALOX15 P16050 2/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ CYP2C9 P11712 1/20 0.42

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
SCHEMBL14375940 0.83 SMN1; SMN2 (0.47) RAB9ANPC1SMN1; SMN2HPGDPOLB
SCHEMBL14375920 0.79 HPGD (0.41) RAB9ANPC1SMN1; SMN2HPGDPOLB
SCHEMBL14375942 0.78 SMN1; SMN2 (0.43) RAB9ANPC1ALDH1A1SMN1; SMN2HPGD
SCHEMBL6745420 0.74 ERCC1 (0.54) NPC1ALDH1A1SMN1; SMN2HPGDLMNA
SCHEMBL14375914 0.73 CA12 (0.40) NPC1SMN1; SMN2HPGDPOLBLMNA
SCHEMBL10386822 0.71 KDM4E (0.57) ALDH1A1SMN1; SMN2HPGDPOLBLMNA
SCHEMBL14375950 0.71 KDM4E (0.42) RAB9ANPC1ALDH1A1SMN1; SMN2HPGD
SCHEMBL14375925 0.69 NTRK1 (0.36) RAB9ANPC1SMN1; SMN2HPGDPOLB
SCHEMBL14347625 0.68 KMT2A (0.43) RAB9ANPC1ALDH1A1SMN1; SMN2HPGD
SCHEMBL14374465 0.68 KMT2A (0.43) RAB9ANPC1ALDH1A1SMN1; SMN2HPGD

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
US-7279576-B2 Anti-cancer medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2007-10-09 — — US disclosed
US-7279576-B2 Anti-cancer medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2007-10-09 — — US disclosed
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