SCHEMBL11337074

SCHEMBL11337074

CCC/C(=C\c1cccc(I)c1)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ DPEP1 P16444 1/20 0.46
▸ ALOX5 P09917 2/20 0.41
▸ PTGES O14684 1/20 0.41
▸ PPARG P37231 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ APP P05067 3/20 0.38
▸ LMNA P02545 1/20 0.38
▸ EPHX2 P34913 1/20 0.37
▸ RECQL P46063 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ HDAC1 Q13547 1/20 0.37
▸ HDAC2 Q92769 1/20 0.37
▸ CAPN1 P07384 1/20 0.35

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
SCHEMBL11337078 1.00 DPEP1 (0.46) DPEP1ALOX5PTGESPPARGCYP3A4
SCHEMBL4500806 0.88 DPEP1 (0.47) DPEP1PPARGCYP3A4CYP2C9APP
SCHEMBL4500803 0.88 DPEP1 (0.47) DPEP1PPARGCYP3A4CYP2C9APP
SCHEMBL3256825 0.82 CYP3A4 (0.59) ALOX5PTGESPPARGCYP3A4CYP2C9
SCHEMBL8858244 0.82 CYP3A4 (0.59) ALOX5PTGESPPARGCYP3A4CYP2C9
SCHEMBL11340472 0.82 AKR1C3 (0.48) ALOX5PTGESPPARGCYP3A4CYP2C9
SCHEMBL11340474 0.82 AKR1C3 (0.48) ALOX5PTGESPPARGCYP3A4CYP2C9
SCHEMBL11324746 0.82 AKR1C3 (0.48) ALOX5PTGESPPARGCYP3A4CYP2C9
SCHEMBL11324744 0.82 AKR1C3 (0.48) ALOX5PTGESPPARGCYP3A4CYP2C9
SCHEMBL11319892 0.81 CAPN1 (0.51) DPEP1ALOX5PTGESPPARGCYP3A4

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
US-4273873-A BONDING SYNTHETIC FIBRINOLYTIC COMPOUND OR ENZYME UNITIKA LTD. (JP) 1981-06-16 — — US disclosed
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