SCHEMBL2287340

SCHEMBL2287340

COc1cc(C(F)(F)F)nc(C(Cl)c2cccc(F)c2N)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.39
KDM4E B2RXH2 5/20 0.33
NPSR1 Q6W5P4 2/20 0.33
ATM Q13315 2/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
L3MBTL1 Q9Y468 3/20 0.32
MAPT P10636 1/20 0.32
HSD17B10 Q99714 1/20 0.32
HIF1A Q16665 1/20 0.32
CYP1A2 P05177 3/20 0.32
CYP2C19 P33261 2/20 0.32
LMNA P02545 1/20 0.32
KMT2A Q03164 1/20 0.31
ADORA2A P29274 1/20 0.31
ADORA1 P30542 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
BLM P54132 1/20 0.31
KRAS P01116 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
SCHEMBL2285840 0.89 NPC1 (0.34) KDM4EALDH1A1HPGDL3MBTL1CYP1A2
SCHEMBL2292839 0.88 KDM4E (0.39) GAAKDM4ENPSR1ATMALDH1A1
SCHEMBL2287221 0.87 GAA (0.40) GAAKDM4ENPSR1ATMALDH1A1
SCHEMBL2286465 0.86 GAA (0.39) GAAKDM4EL3MBTL1MAPTHSD17B10
SCHEMBL2289364 0.84 KMT2A (0.35) ALDH1A1CYP1A2KMT2ANPC1RAB9A
SCHEMBL2285229 0.84 GAA (0.38) GAAKDM4EL3MBTL1MAPTHSD17B10
SCHEMBL2292231 0.77 NPC1 (0.33) MAPTCYP1A2LMNANPC1RAB9A
SCHEMBL2284534 0.77 KDM4E (0.39) GAAKDM4ENPSR1ATMALDH1A1
SCHEMBL2284828 0.76 HSP90AA1 (0.33) KDM4EALDH1A1HPGD
SCHEMBL2292858 0.76 KDM4E (0.39) GAAKDM4ENPSR1ATMALDH1A1

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
EP-1773124-B1 A USE OF SULFONANILIDES AS AGRICULTURAL AND HORTICULTURAL FUNGICIDE BAYER CROPSCIENCE AG (DE) 2012-08-22 EP disclosed
US-8008484-B2 Use of sulfonanilides as agricultural and horticultural fungicide BAYER CROPSCIENCE AG (DE) 2011-08-30 US disclosed
US-20070219199-A1 Use of Sulfonanilides as Agricultural and Horticultural Fungicide BAYER CROPSCIENCE AG (DE) 2007-09-20 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-20070219199-A1 Use of Sulfonanilides as Agricultural and Horticultural Fungicide CBR3, CYP51A1, CBR1 GAA 2292/4885KDM4E 1374/4885NPSR1 197/4885

“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.