SCHEMBL8777799

SCHEMBL8777799

Clc1ccc(Cl)c(Cc2cccc(-c3ncc4ccccc4n3)n2)c1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 11/20 0.39
CYP1A2 P05177 7/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
NPC1 O15118 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
PPP1CA P62136 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CYP2C9 P11712 4/20 0.35
TBXA2R P21731 2/20 0.34
PTGS1 P23219 2/20 0.34
CYP2C19 P33261 2/20 0.34
PTGER3 P43115 2/20 0.34
PTGER2 P43116 2/20 0.34

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
SCHEMBL8778306 0.90 SMN1; SMN2 (0.46) PTGER1CYP1A2MEN1KMT2ANPC1
SCHEMBL3787471 0.89 CYP1A2 (0.37) PTGER1CYP1A2MEN1KMT2ANPC1
SCHEMBL8777914 0.84 KDM4E (0.39) CYP1A2MEN1KMT2AMAPT
SCHEMBL8778144 0.84 USP1 (0.39) CYP1A2NPC1LMNAMAPTHTT
SCHEMBL8778217 0.83 USP1 (0.41) CYP1A2MEN1KMT2ANPC1LMNA
SCHEMBL8778175 0.82 PTGER1 (0.41) PTGER1CYP1A2MEN1KMT2ANPC1
SCHEMBL8777743 0.82 CYP1A2 (0.38) CYP1A2MEN1KMT2ANPC1LMNA
SCHEMBL8778052 0.82 S1PR3 (0.37) PTGER1CYP1A2MEN1KMT2ANPC1
SCHEMBL8778378 0.81 CYP1A2 (0.34) CYP1A2MEN1KMT2ANPC1LMNA
SCHEMBL13063656 0.80 CYP1A2 (0.34) PTGER1CYP1A2MEN1KMT2ASMN1; SMN2

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 PTGER1 4312/4885CYP1A2 18/4885MEN1 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.