SCHEMBL8197213

SCHEMBL8197213

Cc1cc(C)c2oc(C(=O)O)c(-c3ccccc3Cl)c2c1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 2/20 0.43
KMT2A Q03164 7/20 0.40
MEN1 O00255 6/20 0.40
ALDH1A1 P00352 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
CSNK2A2 P19784 2/20 0.39
CSNK2B P67870 2/20 0.39
CSNK2A1 P68400 1/20 0.39
PIM1 P11309 1/20 0.38
PIM3 Q86V86 1/20 0.38
PIM2 Q9P1W9 1/20 0.38
CA12 O43570 1/20 0.38
CA9 Q16790 1/20 0.38
MAPT P10636 1/20 0.38
KDM4E B2RXH2 1/20 0.37
HPGD P15428 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
TTR P02766 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL8200416 0.81 PIM1 (0.49) MCL1KMT2AMEN1ALDH1A1NPSR1
SCHEMBL8187979 0.79 MCL1 (0.46) MCL1KMT2AMEN1ALDH1A1NPSR1
SCHEMBL9219618 0.79 DHODH (0.45) MCL1CSNK2A2CSNK2BCSNK2A1MAPT
SCHEMBL8199806 0.76 S1PR4 (0.41) KMT2AMEN1MAPTHPGDRAB9A
SCHEMBL8202256 0.76 S1PR4 (0.39) KMT2AMEN1NPSR1CSNK2A2CSNK2B
SCHEMBL8201679 0.75 S1PR4 (0.42) KMT2AMEN1NPSR1MAPTRAB9A
SCHEMBL27344482 0.75 GPBAR1 (0.37) ALDH1A1CSNK2A2CSNK2BCSNK2A1PIM1
SCHEMBL9220776 0.74 KMT2A (0.46) MCL1KMT2AMEN1ALDH1A1NPSR1
SCHEMBL27318048 0.73 S1PR4 (0.37) KMT2AMEN1MAPT
SCHEMBL8189218 0.72 S1PR4 (0.47) KMT2AMEN1MAPTRAB9A

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 6 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
CN-1051311-C N-heteroaryl-n'-phenylurea derivatives, their production and use NIHON NOHYAKU CO LTD (JP) 2000-04-12 CN 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
CN-1100417-A N-heteroaryl-n'-phenylurea derivatives, their production and use NIHON NOHYAKU CO LTD (JP) 1995-03-22 CN disclosed
EP-0613894-A1 N-Heteroaryl-N'-phenylurea derivatives, their production and use NIHON NOHYAKU CO., LTD. (JP) 1994-09-07 EP disclosed