SCHEMBL20082340

SCHEMBL20082340

CC1(C)CC/C=C\C=C/CC(=O)O1

nearest known ligand 0.31

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 2/20 0.31
▸ LMNA P02545 2/20 0.31
▸ CYP2C9 P11712 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ CES2 O00748 1/20 0.30
▸ GMNN O75496 1/20 0.30
▸ TDP2 O95551 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ TP53 P04637 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ GLA P06280 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ CYP2D6 P10635 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ HSPD1 P10809 1/20 0.30
▸ THRB P10828 1/20 0.30
▸ NQO1 P15559 1/20 0.30
▸ ALOX15 P16050 1/20 0.30
▸ POR P16435 1/20 0.30

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
SCHEMBL14478498 0.72 IDO1 (0.32) IDO1LMNACYP2C9KDM4EMEN1
SCHEMBL14478500 0.72 IDO1 (0.32) IDO1LMNACYP2C9KDM4EMEN1
SCHEMBL92282 0.66 — —
SCHEMBL894148 0.64 — —
SCHEMBL494066 0.63 — —
SCHEMBL6209797 0.61 LMNA (0.38) IDO1LMNACYP2C9KDM4EMEN1
SCHEMBL18268913 0.60 LMNA (0.37) IDO1LMNACYP2C9KDM4EMEN1
SCHEMBL14476781 0.60 LMNA (0.37) IDO1LMNACYP2C9KDM4EMEN1
SCHEMBL14476976 0.60 LMNA (0.37) IDO1LMNACYP2C9KDM4EMEN1
SCHEMBL17691092 0.60 IDO1 (0.37) IDO1LMNACYP2C9KDM4EMEN1

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-2742083-B1 POLYARYLENE ETHER KETONES SOLVAY SPECIALTY POLYMERS USA (US) 2018-04-25 — — EP disclosed
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