SCHEMBL13638853

SCHEMBL13638853

COCc1ccc(C=O)c(N=O)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ERN1 O75460 4/20 0.43
▸ TRIM24 O15164 1/20 0.38
▸ TYR P14679 1/20 0.38
▸ TRIM33 Q9UPN9 1/20 0.38
▸ ALDH1A1 P00352 5/20 0.35
▸ LMNA P02545 2/20 0.35
▸ TP53 P04637 1/20 0.35
▸ L3MBTL1 Q9Y468 3/20 0.34
▸ MAPT P10636 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ CA2 P00918 1/20 0.33
▸ TUBB1 Q9H4B7 1/20 0.33
▸ TDP1 Q9NUW8 3/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ NPC1 O15118 1/20 0.31
▸ RAB9A P51151 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
SCHEMBL12395454 0.78 RAB9A (0.48) ALDH1A1MAPTKMT2ANPC1RAB9A
SCHEMBL7676025 0.77 ERN1 (0.47) ERN1TRIM24TYRTRIM33ALDH1A1
SCHEMBL23667707 0.76 TDP1 (0.50) ERN1TRIM24TYRTRIM33ALDH1A1
SCHEMBL21417199 0.76 ERN1 (0.46) ERN1TRIM24TYRTRIM33ALDH1A1
SCHEMBL16741207 0.76 ERN1 (0.46) ERN1TRIM24TYRTRIM33ALDH1A1
SCHEMBL1960577 0.76 TYR (0.61) ERN1TRIM24TYRTRIM33LMNA
SCHEMBL12641406 0.75 TAAR1 (0.39) ALDH1A1LMNATP53MAPTTDP1
SCHEMBL12878040 0.74 ALDH1A1 (0.59) ERN1TRIM24TYRTRIM33ALDH1A1
SCHEMBL13062022 0.73 CDK1 (0.47) KMT2A
SCHEMBL17967100 0.72 CDK1 (0.59) ERN1TRIM24TYRTRIM33LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8304547-B2 Azolecarboxamide compound or salt thereof ASTELLAS PHARMA INC. (JP) 2012-11-06 — — US disclosed
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