SCHEMBL15427221

SCHEMBL15427221

CC[S+]([O-])c1cc(C(F)(F)F)ccc1-c1nc2cc(S(F)(F)(F)(F)F)ccc2n1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AGPAT2 O15120 1/20 0.37
▸ CNR2 P34972 3/20 0.33
▸ CNR1 P21554 1/20 0.33
▸ PIK3CA P42336 1/20 0.32
▸ PIK3CB P42338 1/20 0.32
▸ PIK3CG P48736 1/20 0.32
▸ KDM4E B2RXH2 3/20 0.31
▸ HTR3E A5X5Y0 1/20 0.31
▸ HTR3B O95264 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ HTR1A P08908 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ NFKB1 P19838 1/20 0.31
▸ HTR1D P28221 1/20 0.31
▸ HTR2C P28335 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ THPO P40225 1/20 0.31

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
SCHEMBL15426448 0.88 PIK3CA (0.41) AGPAT2CNR2CNR1PIK3CAPIK3CB
SCHEMBL9959554 0.82 PDE2A (0.42) AGPAT2CNR2CNR1PIK3CAPIK3CB
SCHEMBL15427213 0.80 POLB (0.40) —
SCHEMBL15427237 0.80 AGPAT2 (0.40) AGPAT2CNR2CNR1PIK3CAPIK3CB
SCHEMBL167348 0.80 PDE10A (0.40) AGPAT2CNR2CNR1PIK3CAPIK3CB
SCHEMBL15427223 0.79 AGPAT2 (0.39) AGPAT2CNR2PIK3CAPIK3CBPIK3CG
SCHEMBL10280728 0.76 POLB (0.43) AGPAT2CNR2CNR1PIK3CAPIK3CB
SCHEMBL14678192 0.76 AGPAT2 (0.36) AGPAT2CNR2CNR1PIK3CAPIK3CB
SCHEMBL15426412 0.76 POLB (0.36) CNR2CNR1KDM4ETP53PDE2A
SCHEMBL23507303 0.73 BACE1 (0.37) AGPAT2CNR2CNR1PIK3CAPIK3CB

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
EP-3006429-B1 FUSED HETEROCYCLIC COMPOUND AND USE FOR PEST CONTROL THEREOF SUMITOMO CHEMICAL CO (JP) 2019-02-06 — — EP disclosed
EP-3006429-A1 FUSED HETEROCYCLIC COMPOUND AND USE FOR PEST CONTROL THEREOF SUMITOMO CHEMICAL CO., LTD. (JP) 2016-04-13 — — EP disclosed
US-9278983-B2 Fused heterocyclic compound and use thereof for pest control SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-03-08 — — US disclosed
US-20140364444-A1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF FOR PEST CONTROL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-12-11 — — US disclosed
US-8853238-B2 Fused heterocyclic compound and use thereof for pest control SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-10-07 — — US disclosed
US-20140018373-A1 FUSED HETEROCYCLIC COMPOUND AND USE FOR PEST CONTROL THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-01-16 — — 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 (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-20140018373-A1 FUSED HETEROCYCLIC COMPOUND AND USE FOR PEST CONTROL THEREOF NR4A1, NR2C2, NR0B1 AGPAT2 2585/4885CNR2 177/4885CNR1 115/4885
US-20140364444-A1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF FOR PEST CONTROL NR4A1, NR2C2, NR0B1 AGPAT2 2563/4885CNR2 179/4885CNR1 111/4885

“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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