SCHEMBL7253231

SCHEMBL7253231

CC1(C)Oc2ccccc2C(NCc2ccccc2)C1O

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ABCB1 P08183 7/20 0.68
▸ IDO1 P14902 1/20 0.55
▸ KCNE1 P15382 2/20 0.44
▸ KCNQ1 P51787 2/20 0.44
▸ KCNA5 P22460 5/20 0.42
▸ FUCA1 P04066 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ ABCC9 O60706 1/20 0.39
▸ TSHR P16473 1/20 0.39

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
SCHEMBL7253762 0.86 ABCB1 (0.53) ABCB1IDO1KCNE1KCNQ1KCNA5
SCHEMBL9394888 0.81 ABCB1 (1.00) ABCB1ABCC9
SCHEMBL9394883 0.81 ABCB1 (1.00) ABCB1ABCC9
SCHEMBL9394881 0.81 ABCB1 (1.00) ABCB1ABCC9
SCHEMBL10446102 0.80 ABCB1 (0.46) ABCB1IDO1KCNE1KCNQ1KCNA5
SCHEMBL8443304 0.80 ABCB1 (0.61) ABCB1IDO1KCNA5ABCC9
SCHEMBL10445891 0.79 ABCB1 (0.51) ABCB1KCNE1KCNQ1ABCC9
SCHEMBL7258463 0.78 ABCB1 (0.45) ABCB1IDO1KCNE1KCNQ1KCNA5
SCHEMBL7258468 0.77 ABCB1 (0.47) ABCB1IDO1KCNE1KCNQ1KCNA5
SCHEMBL7258474 0.77 ABCB1 (0.47) ABCB1IDO1KCNE1KCNQ1KCNA5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003014113-A1 NOVEL BENZOPYRAN COMPOUNDS AND PROCESS FOR THEIR PREPARATION AND USE GLENMARK PHARMACEUTICALS LIMITED (IN) 2003-02-20 — — WO claimed
WO-2003014113-A1 NOVEL BENZOPYRAN COMPOUNDS AND PROCESS FOR THEIR PREPARATION AND USE GLENMARK PHARMACEUTICALS LIMITED (IN) 2003-02-20 — — WO disclosed
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