SCHEMBL17360625

SCHEMBL17360625

c1ccc(Cc2ccc3ccccc3c2-c2ccccc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GPR55 Q9Y2T6 1/20 0.46
GABRA1 P14867 1/20 0.44
GABRG2 P18507 1/20 0.44
GABRB3 P28472 1/20 0.44

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
SCHEMBL23654686 0.84 MEN1 (0.44) GPR55
SCHEMBL23655124 0.83 SLC22A12 (0.46) GPR55GABRA1GABRG2GABRB3
SCHEMBL29111442 0.82 GPR55 (0.44) GPR55
SCHEMBL28573904 0.81 GPR55 (0.42) GPR55GABRA1GABRG2GABRB3
SCHEMBL24914351 0.81 CYP1A2 (0.43) GPR55GABRG2GABRB3
SCHEMBL7604074 0.81 WDR5 (0.46) GABRA1GABRG2GABRB3
SCHEMBL24914291 0.80 CYP2A6 (0.43) GPR55
SCHEMBL7600324 0.79 WDR5 (0.44) GABRA1GABRG2GABRB3
SCHEMBL6681906 0.79 HPGDS (0.45) GABRA1GABRG2GABRB3
SCHEMBL7931301 0.79 TDP1 (0.41) GABRA1GABRG2GABRB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170143763-A1 ORALLY ADMINISTERED ADSORBENT, THERAPEUTIC AGENT FOR RENAL DISEASE, AND THERAPEUTIC AGENT FOR LIVER DISEASE KUREHA CORPORATION (JP) 2017-05-25 US disclosed
US-20160000827-A1 ORALLY ADMINISTERED ADSORBENT, THERAPEUTIC AGENT FOR RENAL DISEASE, AND THERAPEUTIC AGENT FOR LIVER DISEASE KUREHA CORPORATION (JP) 2016-01-07 US disclosed
US-20150374743-A1 ORALLY ADMINISTERED ADSORBENT, THERAPEUTIC AGENT FOR RENAL DISEASE, AND THERAPEUTIC AGENT FOR LIVER DISEASE KUREHA CORPORATION (JP) 2015-12-31 US disclosed
EP-2959905-A1 ORALLY ADMINISTERED ADSORBENT, THERAPEUTIC AGENT FOR RENAL DISEASE, AND THERAPEUTIC AGENT FOR LIVER DISEASE Kureha Corporation (JP) 2015-12-30 EP disclosed
EP-2959906-A1 ORALLY ADMINISTERED ADSORBENT, THERAPEUTIC AGENT FOR RENAL DISEASE, AND THERAPEUTIC AGENT FOR LIVER DISEASE Kureha Corporation (JP) 2015-12-30 EP disclosed