SCHEMBL8201678

SCHEMBL8201678

Cc1ccc2sc(NC(=O)Nc3c(C)cccc3C(C)C)c(-c3ccccc3Cl)c2c1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 4/20 0.41
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
POLB P06746 1/20 0.39
HPGD P15428 1/20 0.39
NLRP3 Q96P20 3/20 0.37
CXCL8 P10145 1/20 0.37
MAPK1 P28482 1/20 0.36
PYGL P06737 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 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
SCHEMBL8200411 0.95 LPAR1 (0.45) LPAR1KDM4EALDH1A1POLBHPGD
SCHEMBL8196542 0.93 LPAR1 (0.42) LPAR1NLRP3CXCL8MAPK1PYGL
SCHEMBL8196624 0.91 CXCL8 (0.38) LPAR1NLRP3CXCL8MAPK1PYGL
SCHEMBL8197446 0.87 LPAR1 (0.41) LPAR1NLRP3KMT2A
SCHEMBL8197390 0.87 LPAR1 (0.47) LPAR1NLRP3KMT2A
SCHEMBL8195984 0.86 LPAR1 (0.45) LPAR1NLRP3CXCL8MAPK1PYGL
SCHEMBL8196843 0.86 MEN1 (0.36) LPAR1POLBNLRP3CXCL8MAPK1
SCHEMBL8189174 0.86 MEN1 (0.36) LPAR1POLBNLRP3CXCL8MAPK1
SCHEMBL8197433 0.86 LPAR1 (0.40) LPAR1NLRP3KMT2A
SCHEMBL8196116 0.83 S1PR2 (0.42) MEN1KMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE36832-E AN ANTICHOLESTEROL AGENT TREATING HYPERCHOLESTEROLEMIA NIHON NOHYAKU CO., LTD (JP) 2000-08-22 US disclosed
EP-0613894-B1 N-Heteroaryl-N'-phenylurea derivatives, their production and use NIHON NOHYAKU CO LTD (JP) 1999-05-06 EP disclosed
US-5464863-A Anticholesterol agents NIHON NOHYAKU CO., LTD. (JP) 1995-11-07 US disclosed
EP-0613894-A1 N-Heteroaryl-N'-phenylurea derivatives, their production and use NIHON NOHYAKU CO., LTD. (JP) 1994-09-07 EP disclosed