SCHEMBL4991468

SCHEMBL4991468

Nc1ccc(Oc2ccc(C34CC5CC(C3)CC(C36CC7CC(CC(c8ccc(Oc9ccc(N)c(O)c9)cc8)(C7)C3)C6)(C5)C4)cc2)cc1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
ESR1 P03372 1/20 0.43
LMNA P02545 5/20 0.41
MMP2 P08253 1/20 0.40
MMP14 P50281 1/20 0.40
PGR P06401 1/20 0.39
MEN1 O00255 6/20 0.38
KMT2A Q03164 6/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
GFER P55789 1/20 0.38
RAB9A P51151 2/20 0.38
NPC1 O15118 1/20 0.37
GRIN2D O15399 1/20 0.37
GRIN3B O60391 1/20 0.37
GRIN1 Q05586 1/20 0.37
GRIN2A Q12879 1/20 0.37
GRIN2B Q13224 1/20 0.37
GRIN2C Q14957 1/20 0.37
GRIN3A Q8TCU5 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
SCHEMBL2710593 0.94 ESR1 (0.48) ALDH1A1ESR1LMNAMMP2MMP14
SCHEMBL5086572 0.88 MEN1 (0.50) ALDH1A1ESR1LMNAMMP2MMP14
SCHEMBL3191103 0.85 MEN1 (0.39) ALDH1A1ESR1LMNAMMP2MMP14
SCHEMBL31544679 0.83 ALDH1A1 (0.47) ALDH1A1ESR1LMNAPGRMEN1
SCHEMBL2706961 0.83 ALDH1A1 (0.47) ALDH1A1ESR1LMNAPGRMEN1
SCHEMBL2747646 0.82 ALDH1A1 (0.40) ALDH1A1ESR1LMNAPGRMEN1
SCHEMBL2747092 0.82 ALDH1A1 (0.39) ALDH1A1ESR1LMNAPGRMEN1
SCHEMBL3185036 0.81 MMP2 (0.33) ALDH1A1ESR1MMP2MMP14MEN1
SCHEMBL2709501 0.78 MEN1 (0.57) ALDH1A1ESR1LMNAPGRMEN1
SCHEMBL5000706 0.77 MEN1 (0.53) ALDH1A1ESR1LMNAPGRMEN1

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
US-8337982-B2 Comprising first repeating unit obtained by reaction of bisaminophenol compound and dicarboxylic acid, at least one of which has diamondoid structure and second repeating unit obtained by reaction of bisaminophenol compound having no diamondoid structure and dicarboxylic acid; heat resistance SUMITOMO BAKELITE CO., LTD. (JP) 2012-12-25 US disclosed
US-20080206548-A1 Benzoxazole Resin Precursor, Polybenzoxazole Resin, Resin Film And Semiconductor Device SUMITOMO BAKELITE CO., LTD (JP) 2008-08-28 US disclosed
EP-1832619-A1 BENZOXAZOLE RESIN PRECURSOR, POLYBENZOXAZOLE RESIN, RESIN FILM, AND SEMICONDUCTOR DEVICE Sumitomo Bakelite Company, Limited (JP) 2007-09-12 EP disclosed