SCHEMBL14375933

SCHEMBL14375933

Cc1ccc(NC(=O)Nc2ccc(CN3CCS(=O)(=O)CC3)cc2)cc1Nc1ncccn1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.56
▸ RAB9A P51151 2/20 0.56
▸ NPC1 O15118 1/20 0.56
▸ ABL1 P00519 16/20 0.52
▸ KIT P10721 13/20 0.52
▸ BCR P11274 9/20 0.52
▸ ABL2 P42684 8/20 0.52
▸ PDGFRA P16234 2/20 0.52
▸ PLK4 O00444 1/20 0.52
▸ DDX3X O00571 1/20 0.52
▸ GAK O14976 1/20 0.52
▸ SLC22A2 O15244 1/20 0.52
▸ MAPK13 O15264 1/20 0.52
▸ CA12 O43570 1/20 0.52
▸ SLC22A3 O75751 1/20 0.52
▸ ABCB11 O95342 1/20 0.52
▸ EGFR P00533 1/20 0.52
▸ CA1 P00915 1/20 0.52
▸ CA2 P00918 1/20 0.52
▸ LMNA P02545 1/20 0.52

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
SCHEMBL14375804 0.91 ALDH1A1 (0.64) ALDH1A1RAB9ANPC1ABL1KIT
SCHEMBL14375837 0.85 MAPK14 (0.49) ALDH1A1RAB9ANPC1ABL1KIT
SCHEMBL14375919 0.83 ABL1 (0.54) ABL1KITBCRABL2PDGFRA
SCHEMBL14375798 0.80 ABL1 (0.74) ABL1KITBCRABL2PDGFRA
SCHEMBL14375869 0.78 ABL1 (0.72) ABL1KITBCRABL2PDGFRA
SCHEMBL14375838 0.78 ABL1 (0.86) ABL1KITBCRABL2PDGFRA
SCHEMBL14375905 0.77 ABL1 (0.41) ABL1KITBCRABL2PDGFRA
SCHEMBL14375799 0.77 ABL1 (0.58) ALDH1A1RAB9ANPC1ABL1KIT
SCHEMBL14375894 0.76 ABL1 (0.44) ABL1KITBCRABL2PDGFRA
SCHEMBL14375903 0.76 PDGFRA (0.44) ABL1KITBCRABL2PDGFRA

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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