SCHEMBL17696299

SCHEMBL17696299

O=Nc1ccc(-c2cn3c(=O)c(Cc4ccc(F)cc4)nc-3c(Cc3ccccc3)[nH]2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 1/20 0.36
▸ TP53 P04637 2/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ ALDH1A1 P00352 3/20 0.32
▸ HSD17B10 Q99714 2/20 0.32
▸ HPGD P15428 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ LTB4R Q15722 1/20 0.32
▸ CYP1A2 P05177 3/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ CASP1 P29466 1/20 0.32
▸ CASP7 P55210 1/20 0.32
▸ PTGDR2 Q9Y5Y4 1/20 0.32
▸ LMNA P02545 2/20 0.32
▸ CYP3A4 P08684 2/20 0.32
▸ RXFP1 Q9HBX9 1/20 0.31
▸ SIRT5 Q9NXA8 1/20 0.31

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
SCHEMBL23956899 0.94 LTB4R (0.36) SMN1; SMN2ALDH1A1HSD17B10HPGDKDM4E
SCHEMBL16154083 0.91 ADORA3 (0.38) ADORA3TP53SMN1; SMN2ALDH1A1HSD17B10
SCHEMBL17696293 0.90 ABCB1 (0.38) ADORA3ALDH1A1HSD17B10HPGDKDM4E
SCHEMBL17696238 0.89 PTGS2 (0.33) ALDH1A1HSD17B10HPGDKDM4EGAA
SCHEMBL13401854 0.88 ABCB1 (0.39) ADORA3TP53SMN1; SMN2ALDH1A1HSD17B10
SCHEMBL24329824 0.88 ADORA3 (0.39) ADORA3TP53SMN1; SMN2ALDH1A1HSD17B10
SCHEMBL19206667 0.86 LTB4R (0.39) ADORA3ALDH1A1HSD17B10HPGDKDM4E
SCHEMBL492636 0.84 LTB4R (0.41) ADORA3SMN1; SMN2ALDH1A1HSD17B10HPGD
SCHEMBL19810212 0.84 ALDH1A1 (0.38) ADORA3TP53SMN1; SMN2ALDH1A1HSD17B10
SCHEMBL20631363 0.83 ALDH1A1 (0.37) SMN1; SMN2ALDH1A1HSD17B10HPGDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10273463-B2 Chemiluminescent wetness indicator for absorbent products INTERNATIONAL PAPER COMPANY (US) 2019-04-30 — — US disclosed
US-20160108375-A1 CHEMILUMINESCENT WETNESS INDICATOR FOR ABSORBENT PRODUCTS WEYERHAEUSER NR COMPANY (US) 2016-04-21 — — US disclosed
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