SCHEMBL8542124

SCHEMBL8542124

CCCCCOC(C)C[O]

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 1/20 0.43
LPAR3 Q9UBY5 5/20 0.37
LPAR1 Q92633 4/20 0.37
CA1 P00915 7/20 0.37
CA2 P00918 7/20 0.37
CA9 Q16790 7/20 0.37
LPAR2 Q9HBW0 2/20 0.35
CA12 O43570 2/20 0.35
CA3 P07451 2/20 0.35
CA4 P22748 2/20 0.35
CA6 P23280 2/20 0.35
CA5A P35218 2/20 0.35
CA7 P43166 2/20 0.35
CA14 Q9ULX7 2/20 0.35
CA5B Q9Y2D0 2/20 0.35
NAAA Q02083 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
SCHEMBL8542544 0.98 DNM1 (0.47) DNM1LPAR3LPAR1CA1CA2
SCHEMBL709724 0.93
SCHEMBL709883 0.82
SCHEMBL9628657 0.80 DNM1 (0.44) DNM1LPAR3LPAR1CA1CA2
SCHEMBL8400590 0.80 DNM1 (0.46) DNM1LPAR3LPAR1CA1CA2
SCHEMBL1411254 0.79 DNM1 (0.47) DNM1LPAR3LPAR1CA1CA2
SCHEMBL1883777 0.79 DNM1 (0.47) DNM1LPAR3LPAR1CA1CA2
SCHEMBL2330968 0.79 DNM1 (0.47) DNM1LPAR3LPAR1CA1CA2
SCHEMBL1411286 0.79 DNM1 (0.47) DNM1LPAR3LPAR1CA1CA2
SCHEMBL12978500 0.78 DNM1 (0.50) DNM1LPAR3LPAR1LPAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0260910-B1 3,6-DIPHENYLPYRIDAZINES Chisso Corporation (JP) 1992-05-27 EP claimed
EP-0802905-B1 SUBSTITUTED 2-PHENYLPYRIDINES AS HERBICIDES BASF AG (DE) 1998-09-09 EP disclosed
US-5733850-A HERBICIDES, DESICCANTS OR DEFOLIANTS OF PLANTS BASF AKTIENGESELLSCHAFT (DE) 1998-03-31 US disclosed
EP-0802905-A1 SUBSTITUTED 2-PHENYLPYRIDINES AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1997-10-29 EP disclosed
WO-1996021645-A1 SUBSTITUTED 2-PHENYLPYRIDINES AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1996-07-18 WO disclosed
EP-0260910-B1 3,6-DIPHENYLPYRIDAZINES Chisso Corporation (JP) 1992-05-27 EP disclosed
US-4818429-A FERROELECTRIC LIQUID CRYSTAL DISPLAY ELEMENTS; GOOD RESPONSE CHISSO CORPORATION (JP) 1989-04-04 US disclosed
US-4818430-A LIQUID CRYSTALS CHISSO CORPORATION (JP) 1989-04-04 US disclosed
EP-0260910-A1 3,6-Diphenylpyridazines Chisso Corporation (JP) 1988-03-23 EP disclosed
EP-0260153-A2 Cyclohexylphenylpyridazines Chisso Corporation (JP) 1988-03-16 EP disclosed