SCHEMBL7780243

SCHEMBL7780243

Nc1c(Cc2ccc(Br)cc2Br)cccc1C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCB11 O95342 1/20 0.51
▸ LMNA P02545 1/20 0.51
▸ PTGS1 P23219 1/20 0.51
▸ ADORA1 P30542 1/20 0.51
▸ PTGS2 P35354 1/20 0.51
▸ KDM4E B2RXH2 1/20 0.46
▸ GLA P06280 1/20 0.46
▸ G6PD P11413 1/20 0.44
▸ CASP7 P55210 1/20 0.44
▸ CASP6 P55212 1/20 0.44
▸ MAPT P10636 2/20 0.42
▸ POLB P06746 1/20 0.42
▸ AKR1C3 P42330 2/20 0.41
▸ KMT2A Q03164 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ HMGB1 P09429 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ AKR1C4 P17516 1/20 0.37
▸ AKR1C2 P52895 1/20 0.37

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
SCHEMBL28343760 0.87 LMNA (0.47) ABCB11LMNAPTGS1ADORA1PTGS2
SCHEMBL30934865 0.84 G6PD (0.59) ABCB11LMNAPTGS1ADORA1PTGS2
SCHEMBL4444648 0.84 G6PD (0.59) ABCB11LMNAPTGS1ADORA1PTGS2
SCHEMBL7778448 0.75 FABP3 (0.52) G6PDCASP7CASP6ALDH1A1
SCHEMBL3361331 0.74 TSHR (0.57) G6PDCASP7CASP6HMGB1ALDH1A1
SCHEMBL11701728 0.74 G6PD (0.55) ABCB11LMNAPTGS1ADORA1PTGS2
SCHEMBL11548850 0.74 ALDH1A1 (0.52) G6PDCASP7CASP6POLBKMT2A
SCHEMBL7955333 0.73 ALOX15 (0.46) KDM4EMAPTKMT2AMEN1ALDH1A1
SCHEMBL1467995 0.73 TSHR (0.47) KDM4EGLAMAPTPOLBAKR1C3
SCHEMBL808482 0.72 G6PD (0.57) ABCB11LMNAPTGS1ADORA1PTGS2

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-0781767-B1 Process for producing isatoic anhydrides SUMITOMO CHEMICAL CO (JP) 2001-09-05 — — EP disclosed
US-5981749-A Process for producing isatoic anhydrides SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1999-11-09 — — US disclosed
US-5973145-A Process for producing isatoic anhydrides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-10-26 — — US disclosed
US-5795984-A Process for producing isatoic anhydrides SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1998-08-18 — — US disclosed
EP-0781767-A1 Process for producing isatoic anhydrides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-07-02 — — EP disclosed
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