SCHEMBL7862708

SCHEMBL7862708

CCCCCNc1ccc2c(c1)CCC(=O)O2

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.42
CRBN Q96SW2 2/20 0.39
ADRA2A P08913 1/20 0.37
AVPR2 P30518 1/20 0.37
CNR2 P34972 1/20 0.36
AR P10275 1/20 0.36
PLK1 P53350 3/20 0.35
GPR84 Q9NQS5 6/20 0.35
ALDH2 P05091 1/20 0.35
ALDH3A1 P30838 1/20 0.35
KCNH3 Q9ULD8 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
SCHEMBL24217602 0.96 CRBN (0.42) ABL1CRBNAVPR2CNR2AR
SCHEMBL7798265 0.79 ABL1 (0.44) ABL1AVPR2KCNH3
SCHEMBL3624126 0.77 SMN1; SMN2 (0.39) AR
SCHEMBL5728560 0.76 GPR119 (0.51) ABL1CRBNADRA2AAVPR2
SCHEMBL3798500 0.75 CA12 (0.39) AVPR2ALDH2ALDH3A1
SCHEMBL4882989 0.74 ABL1 (0.40) ABL1CRBNADRA2ACNR2AR
SCHEMBL11365984 0.73 ABL1 (0.44) ABL1CRBNADRA2AAVPR2CNR2
SCHEMBL6060993 0.72 ALDH1A1 (0.49) ABL1ADRA2AAVPR2
SCHEMBL7788835 0.72 ABL1 (0.49) ABL1ADRA2AAVPR2
SCHEMBL5110080 0.72 GPR119 (0.54) ABL1CRBNADRA2ACNR2AR

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
EP-0623608-B1 BENZOPYRAN DERIVATIVE, PRODUCTION THEREOF, AND PHARMACEUTICAL PREPARATION CONTAINING THE SAME AS ACTIVE INGREDIENT TEIJIN LTD (JP) 2001-05-30 EP disclosed
EP-0623608-A1 BENZOPYRAN DERIVATIVE, PRODUCTION THEREOF, AND PHARMACEUTICAL PREPARATION CONTAINING THE SAME AS ACTIVE INGREDIENT TEIJIN LIMITED (JP) 1994-11-09 EP disclosed