SCHEMBL8871869

SCHEMBL8871869

COc1ccc(-c2ncc3ccccc3n2)nc1C1CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.40
KDM4E B2RXH2 2/20 0.40
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 1/20 0.40
RAB9A P51151 1/20 0.40
CYP1A2 P05177 2/20 0.38
TRPM8 Q7Z2W7 4/20 0.38
SMO Q99835 2/20 0.37
NQO2 P16083 1/20 0.36
PDE4A P27815 1/20 0.36
TLR8 Q9NR97 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
LMNA P02545 1/20 0.35
PPP1CA P62136 1/20 0.35
CDK1 P06493 1/20 0.35
CDK4 P11802 1/20 0.35
CCNB1 P14635 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
SCHEMBL8778679 0.83 CYP1A2 (0.40) PDE10ANPC1CYP1A2SMOL3MBTL1
SCHEMBL8779764 0.79 SMN1; SMN2 (0.43) SMN1; SMN2KDM4ENPC1ALDH1A1RAB9A
SCHEMBL8779853 0.77 PDGFRB (0.37) SMN1; SMN2KDM4ENPC1ALDH1A1RAB9A
SCHEMBL8778780 0.77 TDP1 (0.43) PDE10ASMN1; SMN2NPC1ALDH1A1RAB9A
SCHEMBL8779812 0.76 L3MBTL1 (0.46) SMN1; SMN2KDM4ENPC1ALDH1A1RAB9A
SCHEMBL8779911 0.74 L3MBTL1 (0.56) SMN1; SMN2KDM4ENPC1ALDH1A1RAB9A
SCHEMBL8778766 0.74 CYP1A2 (0.42) PDE10AKDM4ECYP1A2TRPM8
SCHEMBL8779883 0.73 SMN1; SMN2 (0.39) PDE10ASMN1; SMN2KDM4ENPC1ALDH1A1
SCHEMBL8779778 0.73 ALDH1A1 (0.45) PDE10ASMN1; SMN2KDM4ENPC1ALDH1A1
SCHEMBL3787309 0.73 ALDH1A1 (0.51) SMN1; SMN2KDM4ENPC1ALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120129875-A1 SUBSTITUTED QUINAZOLINES AS FUNGICIDES SYNGENTA CROP PROTECTION, LLC (US) 2012-05-24 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-20120129875-A1 SUBSTITUTED QUINAZOLINES AS FUNGICIDES NAT1, NQO2, NOX1 PDE10A 1335/4885SMN1; SMN2 3646/4885KDM4E 1794/4885

“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.