SCHEMBL11095238

SCHEMBL11095238

CCCCOc1cc2c3c(ccc4c5ccc6c7c(cc(OCCCC)c(c1c34)c75)-c1ccccc1C6=O)C(=O)c1ccccc1-2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 2/20 0.44
▸ MAPK1 P28482 2/20 0.44
▸ GNG2 P59768 1/20 0.44
▸ GNB1 P62873 1/20 0.44
▸ HIF1A Q16665 1/20 0.44
▸ CDC25A P30304 1/20 0.43
▸ CDC25B P30305 1/20 0.43
▸ CDC25C P30307 1/20 0.43
▸ MAPT P10636 3/20 0.43
▸ NPC1 O15118 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ CYP2C9 P11712 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ PTPRC P08575 1/20 0.40
▸ PTPN1 P18031 1/20 0.39

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
SCHEMBL459586 0.95 PTPN1 (0.43) CYP1A2MAPK1GNG2GNB1HIF1A
SCHEMBL28825302 0.95 PTPN1 (0.43) CYP1A2MAPK1GNG2GNB1HIF1A
SCHEMBL431062 0.95 PTPN1 (0.43) CYP1A2MAPK1GNG2GNB1HIF1A
SCHEMBL4951067 0.95 PTPN1 (0.43) CYP1A2MAPK1GNG2GNB1HIF1A
SCHEMBL29537915 0.95 PTPN1 (0.43) CYP1A2MAPK1GNG2GNB1HIF1A
SCHEMBL1353062 0.94 CDC25A (0.43) CYP1A2MAPK1GNG2GNB1HIF1A
SCHEMBL5012564 0.90 PTPN1 (0.43) CYP1A2MAPK1GNG2GNB1HIF1A
SCHEMBL4956759 0.88 PTPN1 (0.41) CYP1A2MAPK1GNG2GNB1HIF1A
SCHEMBL13478137 0.82 PTPN1 (0.34) CYP1A2MAPK1GNG2GNB1HIF1A
SCHEMBL11167805 0.81 POLM (0.49) CYP1A2MAPK1GNG2GNB1HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0073007-B1 METHOD FOR THE SQUARE DIMENSIONAL CONCENTRATION OF LIGHT, AND FLUORESCENT COMPOUNDS BASF Aktiengesellschaft (DE) 1984-12-27 — — EP disclosed
US-4486587-A LIGHFASTNESS, THEROMOSTABILITY BASF AKTIENGESELLSCHAFT (DE) 1984-12-04 — — US disclosed
EP-0073007-A1 Method for the square dimensional concentration of light, and fluorescent compounds BASF Aktiengesellschaft (DE) 1983-03-02 — — EP disclosed
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