SCHEMBL8776930

SCHEMBL8776930

Cc1ccc(-c2ncc3ccccc3n2)nc1-c1ccc(Cl)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.48
NPC1 O15118 3/20 0.42
RAB9A P51151 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
L3MBTL1 Q9Y468 3/20 0.42
KDM4E B2RXH2 3/20 0.42
LMNA P02545 2/20 0.42
GAA P10253 1/20 0.42
PDE10A Q9Y233 2/20 0.41
ATM Q13315 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
CRHR1 P34998 1/20 0.36
NR1H2 P55055 1/20 0.36
NR1H3 Q13133 1/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 2/20 0.35
HTT P42858 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35

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
SCHEMBL8777140 0.89 CYP1A2 (0.50) CYP1A2NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL8776881 0.89 CYP1A2 (0.50) CYP1A2NPC1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL8776938 0.89 PDE10A (0.51) CYP1A2NPC1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL8776962 0.88 CYP1A2 (0.44) CYP1A2NPC1RAB9ASMN1; SMN2PDE10A
SCHEMBL8776659 0.87 CYP1A2 (0.46) CYP1A2NPC1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL8776564 0.87 CYP1A2 (0.46) CYP1A2NPC1RAB9ALMNAPDE10A
SCHEMBL8776954 0.87 CYP1A2 (0.48) CYP1A2NPC1SMN1; SMN2LMNAPDE10A
SCHEMBL9607582 0.87 CYP1A2 (0.48) CYP1A2NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL8777229 0.87 CYP1A2 (0.48) CYP1A2NPC1RAB9AKDM4ELMNA
SCHEMBL8776635 0.86 CYP1A2 (0.45) CYP1A2NPC1RAB9ASMN1; SMN2KDM4E

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 CYP1A2 18/4885NPC1 346/4885RAB9A 814/4885

“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.