SCHEMBL6017271

SCHEMBL6017271

CNc1ccc2[nH]c[c]c2c1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.32
EGFR P00533 2/20 0.30
ASH1L Q9NR48 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL2971945 0.71 KDM4E (0.35) TSHR
SCHEMBL207490 0.71 AHR (0.42) TSHR
SCHEMBL207776 0.71 AHR (0.42) TSHR
SCHEMBL1399575 0.71 NOS1 (0.35)
SCHEMBL1923230 0.71 HTR1D (0.39)
SCHEMBL28463442 0.71 KIF11 (0.41) TSHR
SCHEMBL28464304 0.66 KIF11 (0.37)
SCHEMBL28458649 0.66 KIF11 (0.37)
SCHEMBL28463432 0.66 KIF11 (0.37)
SCHEMBL4493688 0.65 KDM4E (0.44) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5508143-A Optical recording medium PIONEER ELECTRONIC CORPORATION (JP) 1996-04-16 US claimed
EP-1682535-A1 HETEROARYL DERIVATIVES AS PPAR ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2006-07-26 EP disclosed
WO-2005049606-A1 HETEROARYL DERIVATIVES AS PPAR ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2005-06-02 WO disclosed
US-5508143-A Optical recording medium PIONEER ELECTRONIC CORPORATION (JP) 1996-04-16 US disclosed