SCHEMBL17905110

SCHEMBL17905110

CC(C)CO[C@H](C1CCCC1)[C@H](C)OC(=O)[C@H](C)NC(=O)OC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.39
▸ CTSK P43235 4/20 0.38
▸ CTSS P25774 3/20 0.38
▸ HDAC4 P56524 1/20 0.36
▸ HDAC1 Q13547 1/20 0.36
▸ HDAC6 Q9UBN7 1/20 0.36
▸ EPHX1 P07099 1/20 0.36
▸ CA1 P00915 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ CA7 P43166 1/20 0.35
▸ GAA P10253 1/20 0.34
▸ CACNA1B Q00975 2/20 0.33
▸ CA12 O43570 1/20 0.33
▸ CA14 Q9ULX7 1/20 0.33
▸ CTSL P07711 2/20 0.32
▸ AAK1 Q2M2I8 1/20 0.32
▸ CTSB P07858 1/20 0.32
▸ REN P00797 1/20 0.32
▸ BTK Q06187 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
SCHEMBL17896228 0.87 KMT2A (0.43) KMT2ACTSKCTSSHDAC4HDAC1
SCHEMBL17904773 0.87 KMT2A (0.43) KMT2ACTSKCTSSHDAC4HDAC1
SCHEMBL17905112 0.86 KMT2A (0.42) KMT2ACTSKCTSSHDAC4HDAC1
SCHEMBL17905502 0.82 KMT2A (0.45) KMT2ACTSKCTSSCA1CA2
SCHEMBL23649913 0.79 CTSS (0.44) KMT2ACTSKCTSSHDAC4HDAC1
SCHEMBL23649916 0.79 CTSS (0.44) KMT2ACTSKCTSSHDAC4HDAC1
SCHEMBL17905010 0.78 KMT2A (0.38) KMT2AGAACACNA1BCTSLREN
SCHEMBL17905616 0.77 ELANE (0.38) KMT2ACTSKCTSSGAACACNA1B
SCHEMBL17905409 0.77 CA1 (0.41) KMT2ACTSKCTSSCA1CA2
SCHEMBL17905609 0.76 HPGD (0.39) CTSKCTSSGAACACNA1B

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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