SCHEMBL17904991

SCHEMBL17904991

CC[C@H](CCC(C)C)[C@@H](OCC1CC1)[C@H](C)OC(=O)[C@H](C)NC(=O)OC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.40
▸ CTSK P43235 3/20 0.36
▸ CTSS P25774 2/20 0.36
▸ ATM Q13315 2/20 0.36
▸ AAK1 Q2M2I8 1/20 0.33
▸ CNR2 P34972 1/20 0.33
▸ EPHX2 P34913 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ CA1 P00915 1/20 0.32
▸ CA2 P00918 1/20 0.32
▸ CA7 P43166 1/20 0.32

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
SCHEMBL17904824 1.00 KMT2A (0.40) KMT2ACTSKCTSSATMAAK1
SCHEMBL17905158 0.92 KMT2A (0.44) KMT2ACTSKCTSSATMAAK1
SCHEMBL17904993 0.87 CTSK (0.43) KMT2ACTSKCTSSATMAAK1
SCHEMBL17904803 0.86 KMT2A (0.46) KMT2ACTSKCTSSATMAAK1
SCHEMBL17905125 0.82 KMT2A (0.48) KMT2ACTSKCTSSATMAAK1
SCHEMBL17905504 0.81 KMT2A (0.43) KMT2ACTSKCTSSATMAAK1
SCHEMBL17905413 0.80 KMT2A (0.45) KMT2ACTSKCTSSATMAAK1
SCHEMBL17905015 0.80 CA1 (0.37) KMT2ACTSKCTSSEPHX2CA1
SCHEMBL17905501 0.79 KMT2A (0.46) KMT2ACTSKCTSSATMAAK1
SCHEMBL20682983 0.79 KMT2A (0.46) KMT2ACTSKCTSSATMAAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10433555-B2 Picolinamide compounds with fungicidal activity DOW AGROSCIENCES LLC (US) 2019-10-08 — — US disclosed
WO-2016109288-A1 USE OF PICOLINAMIDE COMPOUNDS WITH FUNGICIDAL ACTIVITY DOW AGROSCIENCES LLC (US) 2016-07-07 — — WO disclosed
WO-2016109289-A1 PICOLINAMIDE COMPOUNDS WITH FUNGICIDAL ACTIVITY DOW AGROSCIENCES LLC (US) 2016-07-07 — — WO 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-10433555-B2 Picolinamide compounds with fungicidal activity PFAS, CASP2, CYP1A2 KMT2A 3102/4885CTSK 2808/4885CTSS 1597/4885

“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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