SCHEMBL8946489

SCHEMBL8946489

CCc1cccc(CC)c1NC(=O)Nc1ccc(C2CCCCC2)nc1-c1ccccc1Cl

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PYGL P06737 6/20 0.46
MAPK14 Q16539 1/20 0.41
KMT2A Q03164 2/20 0.41
TAS1R3 Q7RTX0 1/20 0.39
TAS1R1 Q7RTX1 1/20 0.39
CYP2C9 P11712 1/20 0.39
CNR1 P21554 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
PTGES O14684 1/20 0.38
TSHR P16473 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
S1PR4 O95977 1/20 0.37
CXCR2 P25025 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36

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
SCHEMBL8946733 0.86 LPAR1 (0.46) PYGLMAPK14TAS1R3TAS1R1CYP2C9
SCHEMBL8946560 0.83 ANPEP (0.41) PYGLCNR1S1PR4
SCHEMBL27429743 0.76 LMNA (0.37) MAPK14KMT2ACNR1PTGESSMN1; SMN2
SCHEMBL8946926 0.76 NTRK1 (0.53) KMT2AS1PR4
SCHEMBL8946727 0.76 LMNA (0.43) PYGLKMT2ACNR1S1PR4
SCHEMBL8946528 0.74 LMNA (0.41) PYGLCNR1S1PR4
SCHEMBL8946542 0.74 ANPEP (0.40) CNR1S1PR4
SCHEMBL8946397 0.74 S1PR4 (0.39) MAPK14CNR1S1PR4
SCHEMBL8946580 0.73 NPC1 (0.41) KMT2ACNR1NPC1RAB9ASMN1; SMN2
SCHEMBL8946576 0.73 L3MBTL1 (0.51) KMT2ACYP2C9CNR1TSHRSMN1; SMN2

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