SCHEMBL8946397

SCHEMBL8946397

CCc1cccc(CC)c1NC(=O)Nc1cnc(C(C)(C)C)nc1-c1ccccc1Cl

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
S1PR4 O95977 1/20 0.39
MAPK14 Q16539 6/20 0.39
NTRK1 P04629 2/20 0.39
LMNA P02545 1/20 0.39
ANPEP P15144 1/20 0.38
CNR1 P21554 1/20 0.38
PTGER3 P43115 1/20 0.37
CRHBP P24387 1/20 0.37
CRHR2 Q13324 1/20 0.37

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
SCHEMBL8946926 0.87 NTRK1 (0.53) S1PR4NTRK1CRHBPCRHR2
SCHEMBL8946542 0.85 ANPEP (0.40) S1PR4NTRK1ANPEPCNR1PTGER3
SCHEMBL8946569 0.85 LPAR1 (0.46) MAPK14NTRK1LMNA
SCHEMBL8946576 0.84 L3MBTL1 (0.51) NTRK1LMNAANPEPCNR1
SCHEMBL8946580 0.84 NPC1 (0.41) S1PR4NTRK1LMNAANPEPCNR1
SCHEMBL8946713 0.82 L3MBTL1 (0.41) S1PR4NTRK1CNR1
SCHEMBL8946528 0.81 LMNA (0.41) S1PR4LMNAANPEPCNR1
SCHEMBL8946727 0.81 LMNA (0.43) S1PR4LMNACNR1
SCHEMBL8946840 0.80 TP53 (0.42) S1PR4
SCHEMBL8946520 0.79 PIK3R1 (0.43) MAPK14

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-5500424-A ENZYME INHIBITORS NIHON NOHYAKU CO., LTD. (JP) 1996-03-19 US disclosed
EP-0638557-A1 N-phenylpyri(mi)dine-N'-phenyl-urea derivatives, their preparation and their use as ACAT inhibitors NIHON NOHYAKU CO., LTD. (JP) 1995-02-15 EP disclosed