SCHEMBL17905093

SCHEMBL17905093

COc1ccnc(C(=O)N[C@@H](C)C(=O)O[C@@H](C)[C@H](Oc2ccc(Cl)cc2)C2CCCC2)c1O

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 2/20 0.35
▸ HTT P42858 1/20 0.35
▸ MAPT P10636 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ ATM Q13315 1/20 0.34
▸ IDO1 P14902 4/20 0.33
▸ TP53 P04637 4/20 0.33
▸ LMNA P02545 2/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ KDR P35968 1/20 0.33
▸ NR1H4 Q96RI1 1/20 0.32
▸ MDM2 Q00987 2/20 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
SCHEMBL19924427 0.92 HTT (0.33) RAB9AHTTIDO1TP53LMNA
SCHEMBL17904775 0.92 NR3C1 (0.34) RAB9AMAPTTP53LMNANPC1
SCHEMBL17905151 0.92 SMN1; SMN2 (0.33) RAB9AMAPTLMNANPC1HPGD
SCHEMBL17904858 0.91 ALDH1A1 (0.36) RAB9AHTTMAPTMAPK1NPC1
SCHEMBL17896206 0.91 HTT (0.37) HTTMAPK1TP53LMNAHPGD
SCHEMBL17904980 0.91 HTT (0.37) HTTMAPK1TP53LMNAHPGD
SCHEMBL17905086 0.91 ALDH1A1 (0.35) RAB9AHTTMAPK1NPC1HPGD
SCHEMBL17905461 0.89 SMN1; SMN2 (0.36) RAB9AMAPTMAPK1TP53LMNA
SCHEMBL17905666 0.89 XBP1 (0.34) RAB9AMAPTLMNANPC1SMN1; SMN2
SCHEMBL17905193 0.89 MAPT (0.35) RAB9AHTTMAPTMAPK1ATM

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 RAB9A 3281/4885HTT 3579/4885MAPT 1306/4885

“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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