SCHEMBL13757017

SCHEMBL13757017

FCCn1cc(-c2ccccc2)cn1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.61
FEN1 P39748 1/20 0.47
MAPT P10636 1/20 0.44
CREBBP Q92793 3/20 0.43
KDR P35968 1/20 0.40
EPHB4 P54760 1/20 0.40
NAMPT P43490 2/20 0.39
KCNH2 Q12809 3/20 0.39
PDK2 Q15119 5/20 0.39
ADORA2A P29274 1/20 0.38
ADORA1 P30542 1/20 0.38

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
SCHEMBL4653938 0.89 L3MBTL1 (0.65) L3MBTL1FEN1CREBBPKDREPHB4
SCHEMBL27617536 0.83 L3MBTL1 (0.62) L3MBTL1FEN1CREBBPKDREPHB4
SCHEMBL11826508 0.81 L3MBTL1 (0.61) L3MBTL1FEN1KDRNAMPTPDK2
SCHEMBL12528608 0.81 L3MBTL1 (0.61) L3MBTL1MAPTCREBBPKDREPHB4
SCHEMBL21596023 0.81 L3MBTL1 (0.61) L3MBTL1FEN1CREBBPKDREPHB4
SCHEMBL11825597 0.79 L3MBTL1 (0.57) L3MBTL1CREBBPNAMPTPDK2
SCHEMBL2641179 0.79 L3MBTL1 (0.57) L3MBTL1FEN1MAPTCREBBPKDR
SCHEMBL6030409 0.79 L3MBTL1 (0.62) L3MBTL1FEN1MAPTCREBBPKDR
SCHEMBL2641177 0.79 L3MBTL1 (0.57) L3MBTL1FEN1MAPTCREBBPKDR
SCHEMBL15841900 0.78 L3MBTL1 (0.53) L3MBTL1CREBBPKDREPHB4NAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7572753-B2 Tetrazole fungicides CHEMTURA CORPORATION (US) 2009-08-11 US disclosed
US-20070060631-A1 2-cyanomethyl-5-(3-substituted phenyl or 5-substituted thien-2-yl)-2H-tetrazoles; agricultural fungicides such as for rice blast CROMPTON COLORS INCORPORATED 2007-03-15 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-20070060631-A1 2-cyanomethyl-5-(3-substituted phenyl or 5-substituted thien-2-yl)-2H-tetrazoles; agricultural fungicides such as for rice blast TH, HAO2, TDO2 L3MBTL1 1420/4885FEN1 2385/4885MAPT 4286/4885

“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.