SCHEMBL9637273

SCHEMBL9637273

O=c1nc2n(Cc3ccccc3)c3ccccc3nc-2c(=O)[nH]1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.62
▸ KDM4E B2RXH2 2/20 0.62
▸ HTT P42858 2/20 0.62
▸ HPGD P15428 2/20 0.62
▸ GAA P10253 1/20 0.62
▸ CFTR P13569 3/20 0.58
▸ PDE6D O43924 1/20 0.56
▸ ALDH2 P05091 1/20 0.56
▸ ALDH3A1 P30838 1/20 0.56
▸ GSR P00390 2/20 0.55
▸ BRD4 O60885 5/20 0.54
▸ TNF P01375 1/20 0.54
▸ LMNA P02545 2/20 0.52
▸ MAPT P10636 1/20 0.52
▸ TSHR P16473 1/20 0.52
▸ MAPK1 P28482 1/20 0.52
▸ POLB P06746 1/20 0.49
▸ TP53 P04637 1/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ KMT2A Q03164 1/20 0.49

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
SCHEMBL29824098 0.87 HTT (0.62) ALDH1A1KDM4EHTTHPGDGAA
SCHEMBL12287205 0.85 GSR (0.51) ALDH1A1KDM4EHTTHPGDGAA
SCHEMBL11307165 0.84 GSR (0.55) ALDH1A1KDM4EHTTHPGDGAA
SCHEMBL23598674 0.81 KDM4E (0.53) ALDH1A1KDM4EHTTHPGDGAA
SCHEMBL9635970 0.80 HTT (0.54) ALDH1A1KDM4EHTTGAAGSR
SCHEMBL28834402 0.79 GFER (0.53) ALDH1A1KDM4EHTTHPGDGSR
SCHEMBL23918202 0.79 LMNA (0.53) ALDH1A1KDM4EHTTHPGDGSR
SCHEMBL28727266 0.78 TLR8 (0.54) ALDH1A1KDM4EHTTGAAGSR
SCHEMBL864092 0.77 GSR (0.48) ALDH1A1KDM4EHTTHPGDGSR
SCHEMBL9635797 0.77 GSR (0.70) ALDH1A1HTTGSRMAPK1TP53

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-5153236-A Comprising an N-aryl-alpha-amino acid and a photosensitizer such as a thixoanthone, isoalloxazine or coumarine; high sensitivity to UV and visible light; storage stability; photoresists; relief images HITACHI CHEMICAL CO., LTD. (JP) 1992-10-06 — — US claimed
US-5153236-A Comprising an N-aryl-alpha-amino acid and a photosensitizer such as a thixoanthone, isoalloxazine or coumarine; high sensitivity to UV and visible light; storage stability; photoresists; relief images HITACHI CHEMICAL CO., LTD. (JP) 1992-10-06 — — US disclosed
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