SCHEMBL23255173

SCHEMBL23255173

CCCNC(=O)/C(C#N)=C/c1cccc(N)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 7/20 0.62
▸ SMN1; SMN2 Q16637 6/20 0.62
▸ ALDH1A1 P00352 6/20 0.62
▸ MAPK1 P28482 5/20 0.62
▸ LMNA P02545 4/20 0.62
▸ MEN1 O00255 3/20 0.62
▸ KMT2A Q03164 3/20 0.62
▸ MITF O75030 1/20 0.62
▸ MDM2 Q00987 1/20 0.62
▸ EGFR P00533 8/20 0.54
▸ DNM1 Q05193 6/20 0.54
▸ KDM4E B2RXH2 4/20 0.52
▸ TP53 P04637 2/20 0.52
▸ CYP3A4 P08684 2/20 0.52
▸ MAPT P10636 2/20 0.52
▸ ALOX15 P16050 2/20 0.52
▸ ALOX12 P18054 2/20 0.52
▸ NFKB1 P19838 2/20 0.52
▸ RECQL P46063 2/20 0.52
▸ BLM P54132 2/20 0.52

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
SCHEMBL10641674 0.81 SMN1; SMN2 (0.69) HPGDSMN1; SMN2ALDH1A1MAPK1LMNA
SCHEMBL30761786 0.77 KDM4E (0.69) HPGDALDH1A1KMT2AEGFRKDM4E
SCHEMBL30761787 0.77 KDM4E (0.69) HPGDALDH1A1KMT2AEGFRKDM4E
SCHEMBL17394839 0.77 KDM4E (0.69) HPGDALDH1A1KMT2AEGFRKDM4E
SCHEMBL17394841 0.77 KDM4E (0.69) HPGDALDH1A1KMT2AEGFRKDM4E
Hydrochloric Acid SCHEMBL30761788 0.76 KDM4E (0.68) HPGDALDH1A1KMT2AEGFRKDM4E
SCHEMBL11099989 0.72 ALDH1A1 (0.47) HPGDSMN1; SMN2ALDH1A1LMNAMEN1
SCHEMBL11099991 0.72 ALDH1A1 (0.47) HPGDSMN1; SMN2ALDH1A1LMNAMEN1
SCHEMBL17392445 0.72 MAPT (0.49) HPGDSMN1; SMN2ALDH1A1MAPK1LMNA
SCHEMBL17392444 0.72 MAPT (0.49) HPGDSMN1; SMN2ALDH1A1MAPK1LMNA

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
EP-3303283-B1 FTO INHIBITORS NAT INSTITUTE OF BIOLOGICAL SCIENCES BEIJING (CN) 2021-04-21 — — EP disclosed
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