SCHEMBL9753438

SCHEMBL9753438

CCOc1ccc(C(=O)c2cccc(C)c2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.65
LMNA P02545 1/20 0.65
MAPK1 P28482 1/20 0.65
HRH2 P25021 1/20 0.60
HRH1 P35367 1/20 0.60
KMT2A Q03164 3/20 0.58
NPSR1 Q6W5P4 1/20 0.58
TDP1 Q9NUW8 1/20 0.56
NPC1 O15118 3/20 0.52
RAB9A P51151 2/20 0.52
HPGD P15428 2/20 0.52
TSHR P16473 1/20 0.52
PARP10 Q53GL7 1/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
PKM P14618 2/20 0.51
TP53 P04637 1/20 0.51
NFKB1 P19838 1/20 0.51
NFKB2 Q00653 1/20 0.51
RELA Q04206 1/20 0.51
MRGPRX4 Q96LA9 1/20 0.51

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
SCHEMBL11485976 0.89 L3MBTL1 (0.62) L3MBTL1LMNAMAPK1HRH2HRH1
SCHEMBL21567532 0.88 HRH2 (0.61) L3MBTL1LMNAMAPK1HRH2HRH1
SCHEMBL28447243 0.87 HPGD (0.58) L3MBTL1LMNAMAPK1HRH2HRH1
SCHEMBL11003334 0.87 LMNA (0.78) L3MBTL1LMNAMAPK1KMT2ANPSR1
SCHEMBL11807084 0.85 ALDH1A1 (0.56) L3MBTL1LMNAMAPK1HRH2HRH1
SCHEMBL28458398 0.85 GAA (0.69) L3MBTL1LMNAMAPK1HRH2HRH1
SCHEMBL29161052 0.84 LMNA (0.65) L3MBTL1LMNAMAPK1KMT2ANPSR1
SCHEMBL30763329 0.84 LMNA (0.65) L3MBTL1LMNAMAPK1KMT2ANPSR1
SCHEMBL11428607 0.84 HRH2 (0.57) L3MBTL1LMNAMAPK1HRH2HRH1
SCHEMBL30776959 0.83 KMT2A (0.69) L3MBTL1LMNAMAPK1KMT2ANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1991007380-A1 ARTHROPODICIDES DUNLENA PTY. LTD. (AU) 1991-05-30 WO disclosed
US-4115413-A ACID FREE BAYER AKTIENGESELLSCHAFT (DE) 1978-09-19 US disclosed