SCHEMBL22957697

SCHEMBL22957697

CCNCc1c(F)cccc1OCC(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 4/20 0.41
▸ KDM1A O60341 1/20 0.38
▸ MAOA P21397 1/20 0.38
▸ SLC2A1 P11166 2/20 0.37
▸ MEN1 O00255 3/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ MRGPRX1 Q96LB2 2/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ CACNA1G O43497 1/20 0.36
▸ CACNA1H O95180 1/20 0.36
▸ CACNA1C Q13936 1/20 0.36
▸ CACNA1I Q9P0X4 1/20 0.36
▸ GAA P10253 1/20 0.35
▸ UGCG Q16739 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ USP2 O75604 1/20 0.33
▸ HSP90AA1 P07900 1/20 0.33
▸ HSP90AB1 P08238 1/20 0.33

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
SCHEMBL22957867 0.85 MCL1 (0.43) RIPK1KDM1AMAOASLC2A1MEN1
SCHEMBL24018799 0.82 MAPT (0.39) RIPK1KDM1AMAOASLC2A1MEN1
SCHEMBL22957696 0.81 KDM4E (0.37) RIPK1KDM1AMAOASLC2A1UGCG
SCHEMBL22957906 0.81 MEN1 (0.39) RIPK1KDM1AMAOASLC2A1MEN1
SCHEMBL22957681 0.77 RIPK1 (0.42) RIPK1KDM1AMAOAMEN1KMT2A
SCHEMBL22389465 0.77 L3MBTL1 (0.36) RIPK1SLC2A1MEN1KMT2AUGCG
SCHEMBL13970839 0.77 MEN1 (0.49) KDM1AMAOAMEN1KMT2ASMN1; SMN2
SCHEMBL24180186 0.77 ALOX5AP (0.35) RIPK1SLC2A1MEN1KMT2AMRGPRX1
SCHEMBL13696491 0.73 MAPT (0.40) SLC2A1MEN1KMT2AGAAUGCG
SCHEMBL28697944 0.72 L3MBTL1 (0.42) MEN1KMT2AUGCGALDH1A1L3MBTL1

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-10913738-B2 Aminotriazolopyridines as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2021-02-09 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10913738-B2 Aminotriazolopyridines as kinase inhibitors RIPK1, RIPK3, RIPK4 RIPK1 1/4885KDM1A 1022/4885MAOA 4183/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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