SCHEMBL8199588

SCHEMBL8199588

CC(C)c1cccc(C(C)C)c1NC(=O)Nc1sc2cc3c(cc2c1-c1ccccc1Cl)CCC3

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 5/20 0.38
S1PR4 O95977 1/20 0.37
S1PR5 Q9H228 1/20 0.37
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
LMNA P02545 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NLRP3 Q96P20 1/20 0.34

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
SCHEMBL8198115 0.98 S1PR4 (0.39) LPAR1S1PR4S1PR5KMT2AMEN1
SCHEMBL8189174 0.95 MEN1 (0.36) LPAR1KMT2AMEN1NPC1RAB9A
SCHEMBL8196843 0.93 MEN1 (0.36) LPAR1S1PR4S1PR5KMT2AMEN1
SCHEMBL8202399 0.91 LPAR1 (0.43) LPAR1S1PR4S1PR5KMT2AMEN1
SCHEMBL8196165 0.90 LPAR1 (0.38) LPAR1KMT2AMEN1NPC1RAB9A
SCHEMBL8202566 0.89 NPC1 (0.41) KMT2AMEN1NPC1RAB9ATDP1
SCHEMBL8197242 0.88 LPAR1 (0.38) LPAR1KMT2AMEN1NPC1RAB9A
SCHEMBL8200201 0.88 RAB9A (0.38) S1PR4KMT2AMEN1NPC1RAB9A
SCHEMBL8196537 0.87 MEN1 (0.38) LPAR1KMT2AMEN1NPC1RAB9A
SCHEMBL8197446 0.87 LPAR1 (0.41) LPAR1S1PR4S1PR5KMT2ALMNA

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