SCHEMBL8775342

SCHEMBL8775342

Clc1ccc(-c2cccc(-c3ncc4ccccc4n3)n2)c(Cl)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.43
MAPT P10636 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPC1 O15118 1/20 0.41
ALDH1A1 P00352 1/20 0.41
PKM P14618 1/20 0.41
RAB9A P51151 1/20 0.41
GUSB P08236 1/20 0.41
CYP1A2 P05177 3/20 0.40
PIK3CA P42336 3/20 0.39
PIK3CB P42338 3/20 0.39
PIK3CG P48736 3/20 0.39
HSP90AA1 P07900 2/20 0.38
HSP90AB1 P08238 2/20 0.38
AR P10275 1/20 0.37
KDM4E B2RXH2 1/20 0.37
MAPK1 P28482 1/20 0.37
DPP4 P27487 1/20 0.37

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
SCHEMBL8775607 0.89 CYP1A2 (0.40) GRM5MEN1KMT2ASMN1; SMN2NPC1
SCHEMBL8775504 0.87 GRM2 (0.39) GRM5MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL8775144 0.86 CYP1A2 (0.44) GRM5MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL8775888 0.85 NPC1 (0.41) MAPTNPC1CYP1A2AR
SCHEMBL8776019 0.84 IDO1 (0.42) MAPTMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL8775074 0.81 CYP1A2 (0.53) MAPTMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL8776589 0.81 CRHR1 (0.41) GRM5MAPTMEN1KMT2APKM
SCHEMBL8775805 0.81 ALDH1A1 (0.44) MAPTMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL8775758 0.81 GRM5 (0.43) GRM5MEN1KMT2ASMN1; SMN2NPC1
SCHEMBL8775312 0.80 RAB9A (0.51) MAPTMEN1KMT2ASMN1; SMN2NPC1

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 GRM5 2204/4885MAPT 3067/4885MEN1 571/4885

“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.