SCHEMBL8775805

SCHEMBL8775805

COc1ccc(Cl)cc1-c1cccc(-c2ncc3ccccc3n2)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 1/20 0.44
KMT2A Q03164 5/20 0.44
MEN1 O00255 4/20 0.44
PPP1CA P62136 3/20 0.44
MAPT P10636 1/20 0.43
L3MBTL1 Q9Y468 3/20 0.41
POLB P06746 3/20 0.41
ALPL P05186 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 2/20 0.41
GAA P10253 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
AGPAT2 O15120 5/20 0.40
RECQL P46063 1/20 0.39
PIM1 P11309 1/20 0.39
PIM2 Q9P1W9 1/20 0.39

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
SCHEMBL8775725 0.87 MAOA (0.41) ALDH1A1KDM4EKMT2AMEN1PPP1CA
SCHEMBL8775546 0.87 L3MBTL1 (0.47) ALDH1A1KDM4EKMT2AMEN1PPP1CA
SCHEMBL8775539 0.86 L3MBTL1 (0.47) ALDH1A1KDM4EKMT2AMEN1PPP1CA
SCHEMBL8775247 0.85 ALDH1A1 (0.46) ALDH1A1KDM4EKMT2AMEN1MAPT
SCHEMBL8777029 0.84 L3MBTL1 (0.43) ALDH1A1KDM4EKMT2AMEN1PPP1CA
SCHEMBL8776019 0.84 IDO1 (0.42) ALDH1A1KDM4EKMT2AMEN1PPP1CA
SCHEMBL8775607 0.84 CYP1A2 (0.40) ALDH1A1KDM4EKMT2AMEN1ALPL
SCHEMBL8776332 0.83 ALDH1A1 (0.40) ALDH1A1KDM4EKMT2AMEN1MAPT
SCHEMBL8775888 0.83 NPC1 (0.41) MAPTALPLCYP1A2NPC1
SCHEMBL8776285 0.82 MEN1 (0.40) ALDH1A1KDM4EKMT2AMEN1PPP1CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012069652-A2 FUNGICIDE MIXTURES SYNGENTA PARTICIPATIONS AG (CH) 2012-05-31 WO disclosed
US-20120129875-A1 SUBSTITUTED QUINAZOLINES AS FUNGICIDES SYNGENTA CROP PROTECTION, LLC (US) 2012-05-24 US disclosed
US-20120129875-A1 SUBSTITUTED QUINAZOLINES AS FUNGICIDES SYNGENTA CROP PROTECTION, LLC (US) 2012-05-24 US disclosed
WO-2010136475-A1 SUBSTITUTED QUINAZOLINES AS FUNGICIDES SYNGENTA PARTICIPATIONS AG (CH) 2010-12-02 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 (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-20120129875-A1 SUBSTITUTED QUINAZOLINES AS FUNGICIDES NAT1, NQO2, NOX1 ALDH1A1 1125/4885KDM4E 1794/4885KMT2A 2145/4885

“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.