SCHEMBL9322943

SCHEMBL9322943

CCCCCc1c[nH]c(C(=O)O)n1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 3/20 0.44
HCAR3 P49019 2/20 0.44
KCNH2 Q12809 1/20 0.42
PPARA Q07869 1/20 0.39
RARB P10826 6/20 0.39
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.38
RARA P10276 1/20 0.38
MAPT P10636 1/20 0.38
MTOR P42345 1/20 0.38
KMT2A Q03164 1/20 0.38
GPR84 Q9NQS5 3/20 0.37
BID P55957 2/20 0.36
BCL2L1 Q07817 2/20 0.36
MCL1 Q07820 2/20 0.36
BAK1 Q16611 2/20 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
SCHEMBL15284409 0.95 HCAR2 (0.42) HCAR2HCAR3KCNH2RARBALDH1A1
SCHEMBL7579081 0.83 KCNH2 (0.43) HCAR2HCAR3KCNH2PPARAMEN1
SCHEMBL28822502 0.82 HCAR2 (0.38) HCAR2HCAR3ALDH1A1
SCHEMBL300079 0.82 HCAR2 (0.35) HCAR2ALDH1A1MEN1KMT2A
SCHEMBL723349 0.82 KCNH2 (0.42) KCNH2ALDH1A1MEN1KMT2A
SCHEMBL27797675 0.79 IKBKB (0.41) HCAR2HCAR3KCNH2ALDH1A1MEN1
Acetic Acid SCHEMBL28946334 0.77 KCNH2 (0.47) HCAR2HCAR3KCNH2PPARAALDH1A1
SCHEMBL949054 0.77 HDAC1 (0.44) PPARAMAPT
SCHEMBL7601602 0.77 KCNH2 (0.46) HCAR2HCAR3KCNH2ALDH1A1GPR84
SCHEMBL3638798 0.76 KCNH2 (0.38) HCAR2HCAR3KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0365030-B1 Imidazole compound and process for preparing the same ISHIHARA SANGYO KAISHA (JP) 1994-01-26 EP disclosed
US-5023336-A Fungicides, biocides ISHIHARA SANGYO KAISHA LTD. (JP) 1991-06-11 US disclosed
EP-0365030-A1 Imidazole compound and process for preparing the same ISHIHARA SANGYO KAISHA, Ltd. (JP) 1990-04-25 EP disclosed