SCHEMBL14434665

SCHEMBL14434665

Bc1ccc(NC(=O)N2CC(OC)CC2C(=O)Nc2ccc3c(c2)C(C)CN(C)CC3)cc1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 4/20 0.41
▸ CFD P00746 3/20 0.39
▸ KLKB1 P03952 1/20 0.38
▸ KMT2A Q03164 1/20 0.37
▸ NPC1 O15118 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ MET P08581 3/20 0.35
▸ ALK Q9UM73 3/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ DRD2 P14416 2/20 0.33
▸ DRD3 P35462 2/20 0.33
▸ HTR1A P08908 1/20 0.33

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
SCHEMBL14434669 0.93 F10 (0.41) F10CFDKLKB1KMT2ANPC1
SCHEMBL12371503 0.92 F10 (0.41) F10CFDKLKB1KMT2ANPC1
SCHEMBL12371434 0.92 F10 (0.49) F10CFDKLKB1KMT2APOLB
SCHEMBL12371435 0.92 F10 (0.49) F10CFDKLKB1KMT2APOLB
SCHEMBL14434664 0.90 F10 (0.39) F10CFDKLKB1KMT2ANPC1
SCHEMBL14434670 0.90 F10 (0.39) F10KLKB1KMT2ANPC1POLB
SCHEMBL12101413 0.88 F10 (0.43) F10CFDKLKB1NPC1TSHR
SCHEMBL12371502 0.85 F10 (0.41) F10CFDKLKB1KMT2ANPC1
SCHEMBL12371437 0.85 F10 (0.49) F10CFDKLKB1KMT2ANPC1
SCHEMBL12371436 0.85 F10 (0.49) F10CFDKLKB1KMT2ANPC1

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-2007093595-A1 SUBSTITUTED PROLINAMIDES, THEIR PREPARATION AND THEIR USE AS PHARMACEUTICALS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-08-23 — — WO disclosed
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