SCHEMBL9155662

SCHEMBL9155662

Cc1ccc(C(CC(N)=O)C2CCCC2)cc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ CYP2C19 P33261 2/20 0.44
▸ FFAR1 O14842 1/20 0.44
▸ MITF O75030 1/20 0.44
▸ HTR1E P28566 1/20 0.42
▸ S1PR3 Q99500 1/20 0.42
▸ TSHR P16473 1/20 0.41
▸ METAP2 P50579 1/20 0.40
▸ EPHX1 P07099 2/20 0.40
▸ RAB9A P51151 3/20 0.40
▸ NPC1 O15118 2/20 0.40
▸ HPGD P15428 2/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ PLAU P00749 1/20 0.38
▸ HPN P05981 1/20 0.38
▸ ACHE P22303 1/20 0.38
▸ ALOX5 P09917 1/20 0.38

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
SCHEMBL12836119 0.94 FFAR1 (0.50) MEN1KMT2ACYP2C19FFAR1MITF
SCHEMBL17761209 0.94 FFAR1 (0.50) MEN1KMT2ACYP2C19FFAR1MITF
SCHEMBL9153276 0.86 FFAR1 (0.60) MEN1KMT2ACYP2C19FFAR1MITF
SCHEMBL9150014 0.84 FFAR1 (0.44) MEN1KMT2ACYP2C19FFAR1MITF
SCHEMBL27396213 0.83 MEN1 (0.46) MEN1KMT2AFFAR1MITFEPHX1
SCHEMBL8007179 0.83 KMT2A (0.67) MEN1KMT2ACYP2C19FFAR1MITF
SCHEMBL28469916 0.79 FFAR1 (0.51) MEN1KMT2ACYP2C19FFAR1MITF
SCHEMBL9413683 0.79 MEN1 (0.40) MEN1KMT2ACYP2C19FFAR1MITF
SCHEMBL9153116 0.78 SLC6A2 (0.42) MEN1KMT2ACYP2C19MITFHTR1E
SCHEMBL17761361 0.78 FFAR1 (0.50) MEN1KMT2ACYP2C19FFAR1TSHR

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
US-5414008-A Hypotensive and antiatherosclerotic agents BAYER AKTIENGESELLSCHAFT (DE) 1995-05-09 — — US disclosed
EP-0578002-A1 Imidazolyl substituted phenylpropionic and cinnamic acid derivatives BAYER AG (DE) 1994-01-12 — — EP disclosed
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