SCHEMBL24844401

SCHEMBL24844401

CCc1nccnc1-c1ccc(OC(F)F)cn1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 2/20 0.33
RXRA P19793 2/20 0.33
GRIN1 Q05586 2/20 0.33
GRIN2B Q13224 2/20 0.33
TGFBR1 P36897 1/20 0.33
TGFBR2 P37173 1/20 0.33
RAB9A P51151 2/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
PTGES O14684 3/20 0.32
MBOAT4 Q96T53 1/20 0.32
HTT P42858 1/20 0.32
TNKS2 Q9H2K2 2/20 0.32
TNKS O95271 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
MAPK1 P28482 1/20 0.31
MAT2A P31153 1/20 0.30
NPC1 O15118 1/20 0.30
KDM4E B2RXH2 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
SCHEMBL26422943 0.81 MBOAT4 (0.36) RXRAGRIN1GRIN2BTGFBR1TGFBR2
SCHEMBL23329672 0.78 TGFBR1 (0.34) RXRAGRIN1GRIN2BTGFBR1TGFBR2
SCHEMBL24844357 0.75 TGFBR1 (0.36) TGFBR1TGFBR2MAPT
SCHEMBL24926817 0.72 TGFBR1 (0.33) CRHR1TGFBR1ALDH1A1MAPTL3MBTL1
SCHEMBL22510350 0.72 GBA1 (0.40) RAB9AALDH1A1GAAL3MBTL1MAPK1
SCHEMBL24926676 0.72 KDM4E (0.43) RAB9AALDH1A1GAAL3MBTL1MAPK1
SCHEMBL18378650 0.72 MBOAT4 (0.45) RXRAGRIN1GRIN2BRAB9AALDH1A1
SCHEMBL9060768 0.69 MAPT (0.50) RAB9AALDH1A1GAAMAPTHTT
SCHEMBL24470496 0.69 KDM4E (0.45) ALDH1A1HTTL3MBTL1KDM4E
SCHEMBL21816559 0.69 RAB9A (0.50) RAB9AALDH1A1MAPTPTGESHTT

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 3 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-20230131903-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2023-04-27 US disclosed
US-20230002359-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2023-01-05 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 (3 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 CRHR1 1911/4885RXRA 4020/4885GRIN1 414/4885
US-20230142606-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC AMINO COMPOUNDS DDT, ACHE, DDC CRHR1 1987/4885RXRA 4562/4885GRIN1 240/4885
US-20230002359-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC COMPOUNDS DDT, ACHE, GSTO1 CRHR1 1970/4885RXRA 3986/4885GRIN1 368/4885

“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.