SCHEMBL8202399

SCHEMBL8202399

CC(C)c1cccc(C(C)C)c1NC(=O)Nc1sc2cc3c(cc2c1-c1ccc(Cl)cc1Cl)CCC3

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 5/20 0.43
S1PR4 O95977 1/20 0.39
S1PR5 Q9H228 1/20 0.39
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
NLRP3 Q96P20 3/20 0.34
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL8199588 0.91 LPAR1 (0.38) LPAR1S1PR4S1PR5MEN1KMT2A
SCHEMBL8198115 0.89 S1PR4 (0.39) LPAR1S1PR4S1PR5MEN1KMT2A
SCHEMBL8189174 0.86 MEN1 (0.36) LPAR1MEN1KMT2ANLRP3
SCHEMBL8196165 0.84 LPAR1 (0.38) LPAR1MEN1KMT2ATDP1NLRP3
SCHEMBL8196843 0.84 MEN1 (0.36) LPAR1S1PR4S1PR5MEN1KMT2A
SCHEMBL8197242 0.83 LPAR1 (0.38) LPAR1MEN1KMT2ATDP1NLRP3
SCHEMBL8196537 0.82 MEN1 (0.38) LPAR1MEN1KMT2ANLRP3
SCHEMBL8197631 0.81 LPAR1 (0.35) LPAR1MEN1KMT2ATDP1SMN1; SMN2
SCHEMBL8197390 0.81 LPAR1 (0.47) LPAR1S1PR4S1PR5KMT2ANLRP3
SCHEMBL8202512 0.81 LPAR1 (0.42) LPAR1S1PR4S1PR5MEN1KMT2A

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