SCHEMBL22957707

SCHEMBL22957707

CC(C)NCc1cccc(OCC(F)(F)F)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ SLC2A1 P11166 1/20 0.45
▸ CASR P41180 2/20 0.44
▸ HDAC4 P56524 1/20 0.43
▸ MEF2D Q14814 1/20 0.43
▸ CYP17A1 P05093 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ CETP P11597 1/20 0.42
▸ BCHE P06276 2/20 0.42
▸ GRIN1 Q05586 1/20 0.40
▸ GRIN2A Q12879 1/20 0.40
▸ GRIN2B Q13224 1/20 0.40
▸ HCRTR1 O43613 1/20 0.40
▸ HCRTR2 O43614 1/20 0.40
▸ DRD2 P14416 1/20 0.39
▸ DRD3 P35462 1/20 0.39
▸ GRM2 Q14416 1/20 0.39
▸ CD274 Q9NZQ7 1/20 0.39

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
SCHEMBL22957705 0.87 MEN1 (0.43) MEN1KMT2ACASRHDAC4MEF2D
SCHEMBL8292121 0.83 MRGPRX4 (0.48) HDAC4MEF2DCETPBCHEGRIN1
SCHEMBL12933252 0.82 HDAC4 (0.45) MEN1KMT2AHDAC4MEF2DCYP17A1
SCHEMBL13713688 0.82 CARM1 (0.49) SLC2A1CETPGRM2
SCHEMBL5947773 0.81 CASR (0.57) MEN1KMT2ACASRCYP17A1CYP2C9
SCHEMBL13074511 0.81 BCHE (0.49) MEN1KMT2AHDAC4MEF2DBCHE
SCHEMBL8179186 0.80 TAAR1 (0.46) MEN1KMT2ACYP17A1CYP2C9CYP2C19
SCHEMBL5947231 0.79 CD274 (0.48) MEN1KMT2ACASRCETPBCHE
SCHEMBL27595962 0.79 ADRB3 (0.46) MEN1KMT2ACASRHDAC4MEF2D
SCHEMBL22957720 0.78 BCHE (0.49) MEN1KMT2AHDAC4MEF2DBCHE

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
EP-3580220-B1 AMINOTRIAZOLOPYRIDINES AS KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2021-11-17 — — EP disclosed
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 MEN1 3915/4885KMT2A 1255/4885SLC2A1 3967/4885

“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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