SCHEMBL7644147

SCHEMBL7644147

Cc1cc(OP(c2ccc(-c3ccc(P(=O)(Oc4cc(C)c(C(C)(C)C)cc4C(C)(C)C)Oc4cc(C)c(C(C)(C)C)cc4C(C)(C)C)cc3)cc2)c2ccc(-c3ccc(P(=O)(Oc4cc(C)c(C(C)(C)C)cc4C(C)(C)C)Oc4cc(C)c(C(C)(C)C)cc4C(C)(C)C)cc3)cc2)c(C(C)(C)C)cc1C(C)(C)C

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL7643332 0.95
SCHEMBL824488 0.90 CYP1A2 (0.35) CYP1A2CYP2C19
SCHEMBL7643560 0.88
SCHEMBL7640723 0.85 CYP1A2 (0.33) CYP1A2CYP2C19
SCHEMBL824472 0.85 CYP1A2 (0.40) CYP1A2CYP2C19
SCHEMBL7641310 0.82
SCHEMBL824489 0.81 KDM4E (0.32) CYP1A2CYP2C19
SCHEMBL7643336 0.81
SCHEMBL7641824 0.81 CA1 (0.31) CYP1A2CYP2C19
SCHEMBL7616436 0.80

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-6465548-B1 6-HYDROXYCHROMAN DERIVATIVE WITH PHOSPHORUS AND PHENOLIC ANTIOXIDANTS; HEAT, LIGHT AND OXIDATION STABILITY DURING MOLDING YOSHITOMI FINE CHEMICALS, LTD. (JP) 2002-10-15 US disclosed