SCHEMBL17901012

SCHEMBL17901012

COc1ccnc(C(=O)N[C@@H](C)C(=O)OC(C2CC2)[C@H](C)Oc2ccccc2)c1OC(C)=O

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 8/20 0.35
▸ ALDH1A1 P00352 3/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ RECQL P46063 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ CTSA P10619 1/20 0.32
▸ AXL P30530 2/20 0.31
▸ TDP1 Q9NUW8 4/20 0.31
▸ MAPK1 P28482 1/20 0.30
▸ ATM Q13315 1/20 0.30
▸ BRD4 O60885 1/20 0.30
▸ BRPF1 P55201 1/20 0.30
▸ RIPK1 Q13546 1/20 0.30
▸ GPR139 Q6DWJ6 1/20 0.30

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
SCHEMBL17900991 0.96 ALDH1A1 (0.33) MAPTALDH1A1MEN1KMT2ARECQL
SCHEMBL20682950 0.96 ALDH1A1 (0.33) MAPTALDH1A1MEN1KMT2ARECQL
SCHEMBL17901008 0.96 ALDH1A1 (0.33) MAPTALDH1A1MEN1KMT2ARECQL
SCHEMBL17905223 0.95 MAPT (0.35) MAPTALDH1A1MEN1KMT2ARECQL
SCHEMBL17901003 0.91 CTSA (0.32) MAPTALDH1A1NPSR1L3MBTL1POLB
SCHEMBL17905134 0.91 ALDH1A1 (0.33) MAPTALDH1A1MEN1KMT2ARECQL
SCHEMBL17901290 0.89 MAPT (0.36) MAPTALDH1A1MEN1KMT2ARECQL
SCHEMBL22474326 0.89 MAPT (0.36) MAPTALDH1A1MEN1KMT2ARECQL
SCHEMBL17905198 0.88 MTNR1A (0.36) MAPTALDH1A1POLB
SCHEMBL20682788 0.88 ALDH1A1 (0.33) MAPTALDH1A1MEN1KMT2ANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3240419-B1 PICOLINAMIDE COMPOUNDS WITH FUNGICIDAL ACTIVITY DOW AGROSCIENCES LLC (US) 2020-05-06 — — EP disclosed
US-10188109-B2 Picolinamide compounds with fungicidal activity DOW AGROSCIENCES LLC (US) 2019-01-29 — — US disclosed
US-20170360038-A1 PICOLINAMIDE COMPOUNDS WITH FUNGICIDAL ACTIVITY CORTEVA AGRISCIENCE LLC 2017-12-21 — — US disclosed
WO-2016109303-A1 USE OF PICOLINAMIDE COMPOUNDS WITH FUNGICIDAL ACTIVITY DOW AGROSCIENCES LLC (US) 2016-07-07 — — WO disclosed
WO-2016109302-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 (2 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-20170360038-A1 PICOLINAMIDE COMPOUNDS WITH FUNGICIDAL ACTIVITY PFAS, CASP2, CYP1A2 MAPT 1306/4885ALDH1A1 1350/4885MEN1 2200/4885
US-10188109-B2 Picolinamide compounds with fungicidal activity PFAS, CASP2, CYP1A2 MAPT 1306/4885ALDH1A1 1350/4885MEN1 2200/4885

“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.

Send feedback