SCHEMBL10641174

SCHEMBL10641174

Cc1cc(OCc2ccccc2)c(C)cc1OCCCC(C)(C)C(=O)Nc1ccc(/C=C/C(=O)O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.48
▸ LMNA P02545 1/20 0.48
▸ ALDH1A1 P00352 3/20 0.44
▸ HPGD P15428 1/20 0.44
▸ AKR1C3 P42330 2/20 0.44
▸ PPARA Q07869 2/20 0.43
▸ PTGER1 P34995 1/20 0.43
▸ PTGER4 P35408 1/20 0.43
▸ PTGER3 P43115 1/20 0.43
▸ PTGER2 P43116 1/20 0.43
▸ PKM P14618 1/20 0.43
▸ FFAR1 O14842 1/20 0.42
▸ HDAC3 O15379 1/20 0.42
▸ HDAC4 P56524 1/20 0.42
▸ HDAC1 Q13547 1/20 0.42
▸ HDAC7 Q8WUI4 1/20 0.42
▸ HDAC2 Q92769 1/20 0.42
▸ HDAC10 Q969S8 1/20 0.42
▸ HDAC11 Q96DB2 1/20 0.42
▸ HDAC8 Q9BY41 1/20 0.42

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
SCHEMBL10641181 1.00 KDM4E (0.48) KDM4ELMNAALDH1A1HPGDAKR1C3
SCHEMBL10635337 0.91 KDM4E (0.43) KDM4ELMNAALDH1A1HPGDPPARA
SCHEMBL10635333 0.91 KDM4E (0.43) KDM4ELMNAALDH1A1HPGDPPARA
SCHEMBL10638443 0.88 KDM4E (0.47) KDM4EALDH1A1HPGDPPARAHDAC1
SCHEMBL10638439 0.88 KDM4E (0.47) KDM4EALDH1A1HPGDPPARAHDAC1
SCHEMBL10635838 0.87 PPARA (0.42) KDM4EALDH1A1PPARAPKMBACE1
SCHEMBL10635845 0.87 PPARA (0.42) KDM4EALDH1A1PPARAPKMBACE1
SCHEMBL10635807 0.85 PPARA (0.41) KDM4ELMNAALDH1A1HPGDPPARA
SCHEMBL10635836 0.85 PPARA (0.41) KDM4ELMNAALDH1A1HPGDPPARA
SCHEMBL10638488 0.84 PPARA (0.60) KDM4EALDH1A1HPGDPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0134337-B1 SUBSTITUTED 2,2-DIMETHYL-5-PHENOXYPENTANOIC ACID BENZAMIDES AND THEIR PRODUCTION WARNER-LAMBERT COMPANY (US) 1988-01-07 — — EP claimed
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