SCHEMBL23329672

SCHEMBL23329672

CC(C)c1nccnc1-c1ccc(OC(F)F)cn1

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 1/20 0.34
TGFBR2 P37173 1/20 0.34
MAPT P10636 2/20 0.33
GAA P10253 1/20 0.33
PTGES O14684 2/20 0.32
MAT2A P31153 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ROCK1 Q13464 1/20 0.31
MBOAT4 Q96T53 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
KCNH2 Q12809 1/20 0.30
TNKS O95271 1/20 0.30
TNKS2 Q9H2K2 1/20 0.30
RXRA P19793 1/20 0.30
GRIN1 Q05586 1/20 0.30
GRIN2B Q13224 1/20 0.30
HTT P42858 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
SCHEMBL24845019 0.89 CYP3A4 (0.31) KCNH2
SCHEMBL24926671 0.83 NPC1 (0.36) KDM4ETNKS
SCHEMBL26422943 0.82 MBOAT4 (0.36) TGFBR1TGFBR2MAPTGAAMAT2A
SCHEMBL24844401 0.78 CRHR1 (0.33) TGFBR1TGFBR2MAPTGAAPTGES
SCHEMBL23329670 0.76 TGFBR1 (0.36) TGFBR1TGFBR2MAPT
SCHEMBL23329668 0.73 GBA1 (0.33) KDM4ESMN1; SMN2
SCHEMBL24926786 0.73 TGFBR1 (0.33) TGFBR1
SCHEMBL24926677 0.73 NPSR1 (0.40) KDM4EKMT2A
SCHEMBL23212759 0.72 DYRK1A (0.42) KDM4ETNKS
SCHEMBL23212689 0.72 PDCD1 (0.37) KDM4ETNKS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230142606-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC AMINO COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2023-05-11 US disclosed
US-20230142606-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC AMINO COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2023-05-11 US disclosed
US-20230131903-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2023-04-27 US disclosed
US-20230053607-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC AMINO COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2023-02-23 US disclosed
US-20230002359-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2023-01-05 US disclosed
WO-2022101265-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2022-05-19 WO disclosed
WO-2021148639-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2021-07-29 WO disclosed
WO-2021110891-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC AMINO COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2021-06-10 WO 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 (4 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-20230131903-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC COMPOUNDS DDT, ACHE, GSTO1 TGFBR1 1523/4885TGFBR2 1859/4885MAPT 194/4885
US-20230142606-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC AMINO COMPOUNDS DDT, ACHE, DDC TGFBR1 1366/4885TGFBR2 1766/4885MAPT 389/4885
US-20230053607-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC AMINO COMPOUNDS DDT, ACHE, DDC TGFBR1 1366/4885TGFBR2 1766/4885MAPT 389/4885
US-20230002359-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC COMPOUNDS DDT, ACHE, GSTO1 TGFBR1 1553/4885TGFBR2 1914/4885MAPT 283/4885

“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.