Sugi Predict

Sugi Predict / Compounds / SCHEMBL2337569

SCHEMBL2337569

SCHEMBL2337569

CC(C)(C)c1ccc(C(=O)OCn2c(-c3cc(C(F)(F)F)ccn3)noc2=O)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.38
▸ LMNA P02545 5/20 0.38
▸ NPC1 O15118 3/20 0.38
▸ RAB9A P51151 3/20 0.38
▸ MAPT P10636 2/20 0.38
▸ HTT P42858 1/20 0.38
▸ JMJD6 Q6NYC1 1/20 0.37
▸ GAA P10253 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ TP53 P04637 1/20 0.35
▸ APLNR P35414 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ HSP90AA1 P07900 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ XBP1 P17861 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ ABL1 P00519 1/20 0.35
▸ BCR P11274 1/20 0.35

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
SCHEMBL2338781 0.94 ALDH1A1 (0.43) ALDH1A1LMNANPC1RAB9AMAPT
SCHEMBL2336234 0.92 KMT2A (0.40) ALDH1A1LMNANPC1RAB9AMAPT
SCHEMBL2336874 0.90 ALDH1A1 (0.37) ALDH1A1LMNANPC1RAB9AMAPT
SCHEMBL2339120 0.90 ALDH1A1 (0.43) ALDH1A1LMNANPC1RAB9AMAPT
SCHEMBL2340206 0.87 ALDH1A1 (0.47) ALDH1A1LMNANPC1RAB9AJMJD6
SCHEMBL2332039 0.86 JMJD6 (0.37) ALDH1A1LMNANPC1RAB9AMAPT
SCHEMBL2338450 0.86 ALDH1A1 (0.41) ALDH1A1LMNANPC1RAB9AMAPT
SCHEMBL2336388 0.86 JMJD6 (0.36) ALDH1A1LMNANPC1RAB9AMAPT
SCHEMBL2338291 0.86 ALDH1A1 (0.39) ALDH1A1LMNANPC1RAB9AJMJD6
SCHEMBL2339459 0.86 ALDH1A1 (0.40) ALDH1A1LMNANPC1RAB9AMAPT

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
US-8318776-B2 Pyridine compound, pesticidal composition and method of controlling pests SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-11-27 — — US disclosed
US-8318776-B2 Pyridine compound, pesticidal composition and method of controlling pests SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-11-27 — — US disclosed
EP-2215086-B1 PYRIDINE COMPOUND, PESTICIDAL COMPOSITION AND METHOD OF CONTROLLING PEST SUMITOMO CHEMICAL CO (JP) 2011-08-24 — — EP disclosed
US-20100286148-A1 PYRIDINE COMPOUND, PESTICIDAL COMPOSITION AND METHOD OF CONTROLLING PEST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-11-11 — — US disclosed
US-20100286148-A1 PYRIDINE COMPOUND, PESTICIDAL COMPOSITION AND METHOD OF CONTROLLING PEST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-11-11 — — US 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-20100286148-A1 PYRIDINE COMPOUND, PESTICIDAL COMPOSITION AND METHOD OF CONTROLLING PEST C5, PRDX1, PLPBP ALDH1A1 2627/4885LMNA 3135/4885NPC1 4039/4885

“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.