SCHEMBL7942002

SCHEMBL7942002

O=C(Oc1ccccc1C(O)CCc1ccccc1)Oc1ccccc1C(O)CCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 14/20 0.52
CYP2C19 P33261 1/20 0.43
METAP2 P50579 1/20 0.43
METAP1 P53582 1/20 0.43
PTGS2 P35354 1/20 0.42

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
SCHEMBL8585344 0.91 ABCB1 (0.52) ABCB1METAP2METAP1PTGS2
SCHEMBL3913665 0.82 ABCB1 (0.59) ABCB1
SCHEMBL30849681 0.82 ABCB1 (0.59) ABCB1
SCHEMBL7809649 0.79 ABCB1 (0.54) ABCB1CYP2C19
SCHEMBL7942004 0.75 PPARG (0.46)
SCHEMBL30849672 0.75 ABCB1 (0.48) ABCB1CYP2C19
SCHEMBL9657320 0.75 ABCB1 (0.48) ABCB1CYP2C19
SCHEMBL9706052 0.73 NPC1 (0.47) CYP2C19
SCHEMBL1837302 0.73 POLB (0.50) ABCB1CYP2C19
SCHEMBL6535200 0.73 PTGS2 (0.54) PTGS2

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-6197918-B1 INTERCHANGE REACTION OF DIALKYL CARBONATE AND AROMATIC ALCOHOL; CATALYSIS WITH TITANIUM HALIDE, ALKOXIDE, ARYLOXIDE, OR ACETOXIDE GENERAL ELECTRIC COMPANY 2001-03-06 US disclosed
EP-0780361-B1 Manufacturing method for aromatic carbonates GEN ELECTRIC (US) 2000-09-06 EP disclosed
EP-0779312-B1 Manufacturing method for polycarbonate GEN ELECTRIC (US) 2000-05-03 EP disclosed
EP-0780361-A1 Manufacturing method for aromatic carbonates GENERAL ELECTRIC COMPANY (US) 1997-06-25 EP disclosed
EP-0779312-A2 Manufacturing method for polycarbonate GENERAL ELECTRIC COMPANY (US) 1997-06-18 EP disclosed