SCHEMBL5708149

SCHEMBL5708149

C=Cc1cccc(-c2nc3ccccc3o2)c1-c1nc2ccccc2o1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TOP2A P11388 1/20 0.49
▸ PTGS2 P35354 3/20 0.45
▸ ALDH1A1 P00352 7/20 0.44
▸ NPC1 O15118 6/20 0.44
▸ HPGD P15428 5/20 0.44
▸ TP53 P04637 5/20 0.44
▸ RAB9A P51151 5/20 0.44
▸ KDM4E B2RXH2 5/20 0.44
▸ HSD17B10 Q99714 5/20 0.44
▸ MAPT P10636 4/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ PKM P14618 2/20 0.44
▸ GLA P06280 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ CASP1 P29466 1/20 0.44
▸ CASP7 P55210 1/20 0.44
▸ KDM6B O15054 1/20 0.44
▸ KDM6A O15550 1/20 0.44
▸ USP2 O75604 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL6230735 0.88 ALDH1A1 (0.51) TOP2APTGS2ALDH1A1NPC1HPGD
SCHEMBL250150 0.82 TOP2A (0.46) TOP2APTGS2ALDH1A1NPC1HPGD
SCHEMBL19717967 0.82 TOP2A (0.46) TOP2APTGS2ALDH1A1NPC1HPGD
SCHEMBL250148 0.78 TOP2A (0.53) TOP2APTGS2ALDH1A1NPC1HPGD
SCHEMBL22687002 0.78 TOP2A (0.53) TOP2APTGS2ALDH1A1NPC1HPGD
SCHEMBL5335888 0.78 TOP2A (0.53) TOP2APTGS2ALDH1A1NPC1HPGD
SCHEMBL9292548 0.77 TOP2A (0.68) TOP2APTGS2ALDH1A1NPC1HPGD
SCHEMBL27925323 0.77 TOP2A (0.52) TOP2APTGS2ALDH1A1NPC1HPGD
SCHEMBL171055 0.77 TOP2A (0.62) TOP2APTGS2ALDH1A1NPC1HPGD
SCHEMBL29504749 0.77 TOP2A (0.62) TOP2APTGS2ALDH1A1NPC1HPGD

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
US-5152922-A 1,4-DISTYRYLBENZENE COMPOUNDS AND MIXTURES THEREOF WITH OTHER 1,4-DISTYRYBENZENE COMPOUNDS CIBA-GEIGY CORPORATION (US) 1992-10-06 — — US claimed
US-20180320098-A1 PROCESS FOR ENHANCING GASOLINE OCTANE BOOSTERS, GASOLINE BOOSTERS, AND GASOLINES SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2018-11-08 — — US disclosed
EP-3383977-A1 PROCESS FOR ENHANCING GASOLINE OCTANE BOOSTERS, GASOLINE BOOSTERS, AND GASOLINES SABIC Global Technologies B.V. (NL) 2018-10-10 — — EP disclosed
WO-2017093913-A1 PROCESS FOR ENHANCING GASOLINE OCTANE BOOSTERS, GASOLINE BOOSTERS, AND GASOLINES SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2017-06-08 — — WO disclosed
EP-1325067-B1 MULTI-COMPONENT OPTICALLY BRIGHTENED POLYOLEFIN BLEND EASTMAN CHEM CO (US) 2006-09-06 — — EP disclosed
EP-1325067-A1 MULTI-COMPONENT OPTICALLY BRIGHTENED POLYOLEFIN BLEND EASTMAN CHEMICAL COMPANY (US) 2003-07-09 — — EP disclosed
US-6492032-B1 MIXTURE OF BENZOXAZOLYL STILBENES WITH A BIS(BENZOXAZOLYL)-NAPHTHALENE, BIS(BENZOXAZOLYL)THIOPHENE, A PYRAZOLINE AND/OR A COURMARIN; PHOTOGRAPHIC FILMS EASTMAN CHEMICAL COMPANY 2002-12-10 — — US disclosed
WO-2002031035-A1 MULTI-COMPONENT OPTICALLY BRIGHTENED POLYOLEFIN BLEND EASTMAN CHEMICAL COMPANY (US) 2002-04-18 — — WO disclosed
US-5152922-A 1,4-DISTYRYLBENZENE COMPOUNDS AND MIXTURES THEREOF WITH OTHER 1,4-DISTYRYBENZENE COMPOUNDS CIBA-GEIGY CORPORATION (US) 1992-10-06 — — US disclosed
US-4416795-A Mixtures of optical brighteners HOECHST AKTIENGESELLSCHAFT (DE) 1983-11-22 — — US disclosed
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