SCHEMBL8946655

SCHEMBL8946655

CC(C)c1cccc(C(C)C)c1NC(=O)Nc1cnc(-c2cc(Cl)cc(Cl)c2)nc1-c1ccccc1Cl

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 6/20 0.46
L3MBTL1 Q9Y468 1/20 0.41
P2RY1 P47900 1/20 0.41
S1PR4 O95977 1/20 0.40
S1PR5 Q9H228 1/20 0.40
NTRK1 P04629 1/20 0.39
LMNA P02545 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL8946618 0.91 L3MBTL1 (0.51) LPAR1L3MBTL1NTRK1LMNAKMT2A
SCHEMBL8946713 0.86 L3MBTL1 (0.41) L3MBTL1S1PR4NTRK1
SCHEMBL8946456 0.86 LPAR1 (0.50) LPAR1L3MBTL1P2RY1S1PR4S1PR5
SCHEMBL8946420 0.86 L3MBTL1 (0.47) LPAR1L3MBTL1NTRK1
SCHEMBL8946571 0.84 LPAR1 (0.50) LPAR1NTRK1LMNAKMT2A
SCHEMBL8946668 0.84 LPAR1 (0.47) LPAR1P2RY1NTRK1LMNAKMT2A
SCHEMBL8946359 0.84 NTRK1 (0.53) LPAR1NTRK1KMT2A
SCHEMBL8946569 0.82 LPAR1 (0.46) LPAR1P2RY1NTRK1LMNAKMT2A
SCHEMBL8946725 0.81 NTRK1 (0.50) LPAR1P2RY1NTRK1LMNAKMT2A
SCHEMBL8946592 0.80 LPAR1 (0.47) LPAR1P2RY1

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