SCHEMBL8200411

SCHEMBL8200411

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

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 5/20 0.45
NLRP3 Q96P20 2/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
POLB P06746 1/20 0.40
HPGD P15428 1/20 0.40
S1PR4 O95977 1/20 0.38
S1PR5 Q9H228 1/20 0.38
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
HCRTR1 O43613 1/20 0.36
RAB9A P51151 1/20 0.36
LMNA P02545 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
SCHEMBL8201678 0.95 LPAR1 (0.41) LPAR1NLRP3KDM4EALDH1A1POLB
SCHEMBL8197390 0.91 LPAR1 (0.47) LPAR1NLRP3S1PR4S1PR5KMT2A
SCHEMBL8197433 0.90 LPAR1 (0.40) LPAR1NLRP3S1PR4S1PR5KMT2A
SCHEMBL8197446 0.89 LPAR1 (0.41) LPAR1NLRP3S1PR4S1PR5KMT2A
SCHEMBL8196542 0.88 LPAR1 (0.42) LPAR1NLRP3S1PR4S1PR5KMT2A
SCHEMBL8196624 0.85 CXCL8 (0.38) LPAR1NLRP3S1PR4S1PR5KMT2A
SCHEMBL8197561 0.85 POLB (0.41) KDM4EALDH1A1POLBHPGDS1PR4
SCHEMBL8189200 0.85 LPAR1 (0.50) LPAR1S1PR4S1PR5KMT2AMEN1
SCHEMBL8198115 0.84 S1PR4 (0.39) LPAR1NLRP3S1PR4S1PR5KMT2A
SCHEMBL8199588 0.84 LPAR1 (0.38) LPAR1NLRP3S1PR4S1PR5KMT2A

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