SCHEMBL9657941

SCHEMBL9657941

CCCNC(=O)Oc1cc(OCC)c(OC(=O)NCCC)c2ccc(Cl)cc12

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.40
THRB P10828 1/20 0.40
RECQL P46063 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL10643955 0.89 ABCB11 (0.44)
SCHEMBL9654842 0.85 ABCB11 (0.47) POLBTHRBRECQLTDP1L3MBTL1
SCHEMBL9656605 0.85 NCEH1 (0.44) POLB
SCHEMBL9657721 0.83 MGLL (0.47)
SCHEMBL9660646 0.82 SLC2A1 (0.45) POLB
SCHEMBL9657769 0.81 MGLL (0.54)
SCHEMBL9658010 0.81 SLC2A1 (0.48)
SCHEMBL9628176 0.80 ABCB11 (0.56) POLB
SCHEMBL9660000 0.80 ABCB11 (0.44) POLB
SCHEMBL9657945 0.80 ABCB11 (0.47) POLB

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
US-5134161-A Enzyme inhibitors for skin disorders, antiinflammatory agents SYNTEX (U.S.A.) INC. (US) 1992-07-28 US disclosed
US-4786652-A TOPICAL ADMINISTRATION SYNTEX (U.S.A.) INC. (US) 1988-11-22 US disclosed
EP-0282006-A1 Naphtalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1988-09-14 EP disclosed