SCHEMBL23301033

SCHEMBL23301033

CC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1N

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.44
P2RX1 P51575 1/20 0.39
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 2/20 0.39
HPGD P15428 2/20 0.39
HSD17B10 Q99714 2/20 0.39
CFTR P13569 2/20 0.38
NOTUM Q6P988 1/20 0.36
AKR1C3 P42330 1/20 0.35
AKR1C2 P52895 1/20 0.35
CACNA1H O95180 1/20 0.35
MAPT P10636 1/20 0.35
KIF11 P52732 1/20 0.35
RXRA P19793 1/20 0.34
RXRB P28702 1/20 0.34
USP2 O75604 1/20 0.34
CYP2C19 P33261 1/20 0.34
PTGS1 P23219 2/20 0.34

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
SCHEMBL29656849 1.00 CES2 (0.44) CES2P2RX1ALDH1A1KDM4EHPGD
SCHEMBL23301178 0.84 CES2 (0.46) CES2P2RX1ALDH1A1KDM4EHPGD
SCHEMBL29664374 0.82 P2RX1 (0.39) CES2P2RX1ALDH1A1KDM4EHPGD
SCHEMBL24801799 0.82 KDM4E (0.42) CES2P2RX1ALDH1A1KDM4ECFTR
SCHEMBL20670582 0.82 P2RX1 (0.39) CES2P2RX1ALDH1A1KDM4EHPGD
SCHEMBL29945921 0.82 KIF11 (0.38) CES2P2RX1ALDH1A1KDM4EHPGD
SCHEMBL23526580 0.82 KIF11 (0.38) CES2P2RX1ALDH1A1KDM4EHPGD
SCHEMBL5403595 0.81 TMPRSS4 (0.40) KDM4ECFTRAKR1C3AKR1C2MAPT
SCHEMBL3579114 0.79 CES2 (0.44) CES2P2RX1ALDH1A1KDM4EHPGD
SCHEMBL23458637 0.76 CES2 (0.38) CES2ALDH1A1KDM4EHPGDHSD17B10

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-4643644-A2 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC COMPOUNDS Syngenta Crop Protection AG (CH) 2025-11-05 EP disclosed
EP-4051673-B1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2025-09-24 EP disclosed
US-20230002359-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2023-01-05 US disclosed
EP-4051673-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC COMPOUNDS Syngenta Crop Protection AG (CH) 2022-09-07 EP disclosed
WO-2021083936-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2021-05-06 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-20230002359-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC COMPOUNDS DDT, ACHE, GSTO1 CES2 320/4885P2RX1 1191/4885ALDH1A1 746/4885

“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.