SCHEMBL7754052

SCHEMBL7754052

O=C(c1ccccc1)c1ccccc1OCC(O)CO

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 15/20 0.69
SCN1A P35498 1/20 0.55
SCN5A Q14524 1/20 0.55
SCN9A Q15858 1/20 0.55
CYP1A2 P05177 2/20 0.54
KDM4E B2RXH2 1/20 0.54
AGTR1 P30556 1/20 0.54
LMNA P02545 1/20 0.54

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
SCHEMBL7050989 0.86 CYP1A2 (0.58) ABCB1CYP1A2KDM4EAGTR1LMNA
Hydrochloric Acid SCHEMBL9618972 0.84 ABCB1 (0.67) ABCB1SCN1ASCN5ASCN9A
SCHEMBL9627874 0.83 ABCB1 (0.65) ABCB1SCN1ASCN5ASCN9A
SCHEMBL9626893 0.83 POLB (0.61) ABCB1CYP1A2KDM4EAGTR1LMNA
SCHEMBL11631740 0.81 CYP1A2 (0.57) ABCB1CYP1A2KDM4EAGTR1LMNA
SCHEMBL6675280 0.81 CYP1A2 (0.61) ABCB1CYP1A2KDM4EAGTR1LMNA
SCHEMBL30109393 0.81 ABCB1 (0.63) ABCB1
SCHEMBL11155287 0.81 ABCB1 (0.62) ABCB1SCN1ASCN5ACYP1A2AGTR1
SCHEMBL15463392 0.81 ABCB1 (0.60) ABCB1SCN1ASCN5ASCN9A
SCHEMBL29478062 0.81 ABCB1 (0.60) ABCB1SCN1ASCN5ASCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0538839-B1 Benzophenone derivative, utraviolet absorbent and external preparation for skin SHISEIDO CO LTD (JP) 2001-01-24 EP disclosed
US-5342610-A Sunscreen agent SHISEIDO CO., LTD. (JP) 1994-08-30 US disclosed
EP-0538839-A1 Benzophenone derivative, utraviolet absorbent and external preparation for skin SHISEIDO COMPANY LIMITED (JP) 1993-04-28 EP disclosed