SCHEMBL4670276

SCHEMBL4670276

COCC(CCO)OCCO

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LPAR6 P43657 2/20 0.35
LPAR1 Q92633 2/20 0.35
LPAR4 Q99677 2/20 0.35
LPAR5 Q9H1C0 2/20 0.35
LPAR2 Q9HBW0 2/20 0.35
LPAR3 Q9UBY5 2/20 0.35
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.30
MAPK1 P28482 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
SCHEMBL9611250 1.00 LPAR6 (0.35) LPAR6LPAR1LPAR4LPAR5LPAR2
SCHEMBL14643062 0.87 LPAR6 (0.38) LPAR6LPAR1LPAR4LPAR5LPAR2
SCHEMBL7777378 0.84
SCHEMBL7776041 0.83 TSHR (0.41) LPAR1LPAR2LPAR3ALDH1A1TSHR
SCHEMBL6658678 0.82 ALDH1A1 (0.46) LPAR6LPAR1LPAR4LPAR5LPAR2
SCHEMBL4847179 0.82 MEN1 (0.35) LPAR6LPAR1LPAR4LPAR5LPAR2
SCHEMBL14000853 0.82 ALDH1A1 (0.33) LPAR6LPAR1LPAR4LPAR5LPAR2
SCHEMBL7771270 0.82 ALDH1A1 (0.33) LPAR6LPAR1LPAR4LPAR5LPAR2
SCHEMBL10592766 0.81 LPAR1 (0.55) LPAR6LPAR1LPAR4LPAR5LPAR2
SCHEMBL14642724 0.80 LPAR1 (0.39) LPAR6LPAR1LPAR4LPAR5LPAR2

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
EP-1613300-B1 PHOTOSTABILIZED TOPICAL FORMULATIONS OF KETOPROFEN CONTAINING TWO UV FILTERS BERLIN CHEMIE AG (DE) 2008-12-10 EP disclosed
EP-0733045-B1 4,6-DIANILINO-PYRIMIDINE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS TYROSINE KINASE INHIBITORS ASTRAZENECA AB (SE) 2001-08-16 EP disclosed
US-5880130-A TREATMENT OF CELL-PROLIFERATION DISEASES ZENECA LIMITED (GB) 1999-03-09 US disclosed
EP-0733045-A1 4,6-DIANILINO-PYRIMIDINE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS TYROSINE KINASE INHIBITORS ZENECA LIMITED (GB) 1996-09-25 EP disclosed
WO-1995015952-A1 4,6-DIANILINO-PYRIMIDINE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS TYROSINE KINASE INHIBITORS ZENECA LIMITED (GB) 1995-06-15 WO disclosed