SCHEMBL17904993

SCHEMBL17904993

CC[C@H](CC1CCCC1)[C@@H](OCC1CC1)[C@H](C)OC(=O)[C@H](C)NC(=O)OC(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 4/20 0.43
▸ CTSS P25774 2/20 0.43
▸ KMT2A Q03164 2/20 0.40
▸ AAK1 Q2M2I8 2/20 0.35
▸ REN P00797 3/20 0.34
▸ CTSD P07339 1/20 0.34
▸ CTSE P14091 1/20 0.34
▸ CACNA1B Q00975 2/20 0.33
▸ CTSL P07711 2/20 0.32
▸ CTSB P07858 2/20 0.32
▸ METAP2 P50579 1/20 0.32
▸ CTSH P09668 1/20 0.32
▸ ATM Q13315 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
SCHEMBL17905158 0.92 KMT2A (0.44) CTSKCTSSKMT2AAAK1ATM
SCHEMBL17904824 0.87 KMT2A (0.40) CTSKCTSSKMT2AAAK1ATM
SCHEMBL17904991 0.87 KMT2A (0.40) CTSKCTSSKMT2AAAK1ATM
SCHEMBL17904803 0.85 KMT2A (0.46) CTSKCTSSKMT2AAAK1CTSL
SCHEMBL21985404 0.81 SLC1A3 (0.35) CTSKCTSLCTSBCTSH
SCHEMBL17905125 0.81 KMT2A (0.48) CTSKCTSSKMT2AAAK1CACNA1B
SCHEMBL17901092 0.81 CTSK (0.42) CTSKCTSSKMT2AAAK1CACNA1B
SCHEMBL20682985 0.81 CTSK (0.42) CTSKCTSSKMT2AAAK1CACNA1B
SCHEMBL20682983 0.80 KMT2A (0.46) CTSKCTSSKMT2AAAK1CTSL
SCHEMBL17901296 0.80 KMT2A (0.46) CTSKCTSSKMT2AAAK1CTSL

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-2016109289-A1 PICOLINAMIDE COMPOUNDS WITH FUNGICIDAL ACTIVITY DOW AGROSCIENCES LLC (US) 2016-07-07 — — WO disclosed
WO-2016109288-A1 USE OF 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 CTSK 2808/4885CTSS 1597/4885KMT2A 3102/4885

“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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