SCHEMBL20876152

SCHEMBL20876152

CC1=Cc2ccc(Cl)cc2[N]1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.34
MAPK1 P28482 1/20 0.34
ALDH1A1 P00352 2/20 0.32
POLB P06746 1/20 0.32
HSD11B1 P28845 1/20 0.32
TP53 P04637 1/20 0.31
RAPGEF4 Q8WZA2 1/20 0.31
NR4A2 P43354 1/20 0.31
ROCK1 Q13464 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
USP2 O75604 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL66594 0.69 TSHR (0.35)
SCHEMBL7817367 0.64 MAPK1 (0.39) CYP3A4MAPK1ALDH1A1POLBHSD11B1
SCHEMBL7868500 0.62 HPGD (0.33) CYP3A4TP53RAPGEF4KDM4EMEN1
SCHEMBL209538 0.61 TP53 (0.33) CYP3A4MAPK1ALDH1A1TP53NR4A2
SCHEMBL322631 0.61 TP53 (0.33) CYP3A4ALDH1A1TP53KDM4EMEN1
SCHEMBL323047 0.58 MAPK1 (0.41) CYP3A4MAPK1ALDH1A1POLBHSD11B1
SCHEMBL5953558 0.58 DRD2 (0.38) CYP3A4
SCHEMBL2327323 0.58 TP53 (0.35) CYP3A4MAPK1ALDH1A1POLBTP53
SCHEMBL9092157 0.58 HSD11B1 (0.39) CYP3A4POLBHSD11B1TP53RAPGEF4
SCHEMBL14743082 0.58 S100A4 (0.44) CYP3A4ALDH1A1TP53MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11629138-B2 Microbiocidal picolinamide derivatives SYNGENTA PARTICIPATIONS AG (CH) 2023-04-18 US disclosed
EP-3692029-B1 MICROBIOCIDAL PICOLINAMIDE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2023-04-12 EP disclosed
US-20200255400-A1 Microbiocidal Picolinamide Derivatives SYNGENTA PARTICIPATIONS AG (CH) 2020-08-13 US disclosed
EP-3692029-A1 MICROBIOCIDAL PICOLINAMIDE DERIVATIVES Syngenta Participations AG (CH) 2020-08-12 EP disclosed
CN-111194314-A Microbicidal picolinamide derivatives 先正达参股股份有限公司 2020-05-22 CN disclosed
WO-2019068809-A1 MICROBIOCIDAL PICOLINAMIDE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2019-04-11 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-20200255400-A1 Microbiocidal Picolinamide Derivatives PRF1, CASP1, FPR1 CYP3A4 587/4885MAPK1 3249/4885ALDH1A1 1067/4885
US-11629138-B2 Microbiocidal picolinamide derivatives PRF1, CASP1, FPR1 CYP3A4 587/4885MAPK1 3249/4885ALDH1A1 1067/4885

“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.