SCHEMBL22349487

SCHEMBL22349487

CCn1c(C(F)(F)F)cc2nc(-c3nc(-c4ccc(F)c(F)c4)ccc3S(=O)(=O)CC)n(C)c2c1=O

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 3/20 0.33
▸ PTGS2 P35354 2/20 0.33
▸ CYP1A2 P05177 2/20 0.32
▸ CYP3A4 P08684 2/20 0.32
▸ HSD17B10 Q99714 2/20 0.32
▸ USP2 O75604 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ DDR1 Q08345 5/20 0.31
▸ PTGS1 P23219 1/20 0.31
▸ TSHR P16473 1/20 0.30
▸ CA1 P00915 1/20 0.30
▸ CA2 P00918 1/20 0.30
▸ PADI4 Q9UM07 1/20 0.30
▸ MAPT P10636 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
SCHEMBL22349522 0.93 DDR1 (0.32) DDR1
SCHEMBL22349444 0.91 DDR1 (0.35) PTGS2CYP1A2CYP3A4HSD17B10ALDH1A1
SCHEMBL22349406 0.91 PTGS1 (0.37) PTGS2CYP1A2ALDH1A1PTGS1PADI4
SCHEMBL22349517 0.91 DDR1 (0.34) CYP1A2HSD17B10USP2ALDH1A1DDR1
SCHEMBL18357978 0.90 KDM4E (0.36) ALDH1A1DDR1
SCHEMBL22349369 0.89 DDR1 (0.34) PTGS2CYP1A2CYP3A4HSD17B10USP2
SCHEMBL22349438 0.89 DDR1 (0.33) TRPA1DDR1
SCHEMBL22349400 0.89 ADORA2B (0.35) HSD17B10ALDH1A1DDR1TSHRMAPT
SCHEMBL22349445 0.89 DDR1 (0.35) DDR1
SCHEMBL22349403 0.88 DDR1 (0.33) DDR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10745396-B2 Pesticidally active polycyclic derivatives with sulfur containing substituents SYNGENTA PARTICIPATIONS AG (CH) 2020-08-18 — — 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-10745396-B2 Pesticidally active polycyclic derivatives with sulfur containing substituents DDT, SQOR, ACHE TRPA1 72/4885PTGS2 586/4885CYP1A2 135/4885

“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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