SCHEMBL8778217

SCHEMBL8778217

Clc1ccc(Cc2cccc(-c3ncc4ccccc4n3)n2)cc1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP1 O94782 3/20 0.41
WDR48 Q8TAF3 3/20 0.41
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
ADORA2A P29274 1/20 0.37
ATM Q13315 1/20 0.37
CYP1A2 P05177 3/20 0.36
TDP1 Q9NUW8 2/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
SLC6A2 P23975 2/20 0.35
SLC6A4 P31645 2/20 0.35
SLC6A3 Q01959 2/20 0.35
NPC1 O15118 1/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
MET P08581 1/20 0.33

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
SCHEMBL8778292 0.90 CYP1A2 (0.34) USP1WDR48KMT2AMEN1LMNA
SCHEMBL8777914 0.86 KDM4E (0.39) KMT2AMEN1CYP1A2
SCHEMBL8778144 0.86 USP1 (0.39) USP1WDR48LMNANPSR1CYP1A2
SCHEMBL8515683 0.84 KMT2A (0.38) KMT2ACYP1A2SLC6A2SLC6A4SLC6A3
SCHEMBL29368748 0.83 CYP1A2 (0.40) USP1WDR48KMT2AMEN1CYP1A2
SCHEMBL3787262 0.83 CYP1A2 (0.40) USP1WDR48KMT2AMEN1CYP1A2
SCHEMBL8778211 0.83 CYP1A2 (0.38) USP1WDR48LMNAADORA2ACYP1A2
SCHEMBL8777799 0.83 PTGER1 (0.39) KMT2AMEN1LMNACYP1A2TDP1
SCHEMBL8777743 0.82 CYP1A2 (0.38) KMT2AMEN1LMNANPSR1CYP1A2
SCHEMBL8778044 0.81 CYP2C19 (0.38) USP1WDR48KMT2AMEN1LMNA

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 USP1 2963/4885WDR48 4477/4885KMT2A 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.