SCHEMBL23249598

SCHEMBL23249598

Cc1ccccc1[C@@H](C)[C@@H](C)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.48
GAA P10253 1/20 0.43
ACP3 P15309 1/20 0.41
TSHR P16473 3/20 0.41
ACHE P22303 1/20 0.41
GABRA1 P14867 2/20 0.39
GABRB2 P47870 2/20 0.39
ALDH1A1 P00352 2/20 0.36
SLC6A2 P23975 3/20 0.36
CYP3A4 P08684 2/20 0.36
SLC6A4 P31645 2/20 0.36
SLC6A3 Q01959 2/20 0.36
FAAH O00519 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
LMNA P02545 1/20 0.36
CYP1A2 P05177 1/20 0.36
HPGD P15428 1/20 0.36
GABRB1 P18505 1/20 0.36
GABRG2 P18507 1/20 0.36

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
SCHEMBL21338870 1.00 ESR1 (0.48) ESR1GAAACP3TSHRACHE
SCHEMBL29721507 1.00 ESR1 (0.48) ESR1GAAACP3TSHRACHE
SCHEMBL23249594 1.00 ESR1 (0.48) ESR1GAAACP3TSHRACHE
SCHEMBL11000733 1.00 ESR1 (0.48) ESR1GAAACP3TSHRACHE
SCHEMBL6546306 0.85 ESR1 (0.56) ESR1GAAACP3TSHRACHE
SCHEMBL17446315 0.83 ESR1 (0.50) ESR1GAAACP3TSHRACHE
SCHEMBL17446316 0.83 ESR1 (0.50) ESR1GAAACP3TSHRACHE
SCHEMBL14040083 0.83 ESR1 (0.50) ESR1GAAACP3TSHRACHE
SCHEMBL13993318 0.82 ESR1 (0.59) ESR1GAAACP3TSHRACHE
SCHEMBL18568074 0.80 ESR1 (0.52) ESR1GAAACP3TSHRACHE

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-20220411375-A1 PROCESS FOR SYNTHESIS OF PICOLINAMIDES CORTEVA AGRISCIENCE LLC (US) 2022-12-29 US disclosed
US-20220411375-A1 PROCESS FOR SYNTHESIS OF PICOLINAMIDES CORTEVA AGRISCIENCE LLC (US) 2022-12-29 US disclosed
CN-114554848-A Process for the synthesis of picolinamides 科迪华农业科技有限责任公司 2022-05-27 CN disclosed
WO-2021076681-A1 PROCESS FOR SYNTHESIS OF PICOLINAMIDES DOW AGROSCIENCES LLC (US) 2021-04-22 WO disclosed
WO-2021076681-A1 PROCESS FOR SYNTHESIS OF PICOLINAMIDES DOW AGROSCIENCES LLC (US) 2021-04-22 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-20220411375-A1 PROCESS FOR SYNTHESIS OF PICOLINAMIDES NPEPPS, ANPEP, DNPEP ESR1 4051/4885GAA 756/4885ACP3 311/4885

“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.