SCHEMBL8778629

SCHEMBL8778629

Fc1ccc(Sc2cccc(-c3ncc4ccccc4n3)n2)cc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
PPP1CA P62136 1/20 0.44
KMT2A Q03164 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
GRM5 P41594 10/20 0.42
HPGD P15428 1/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
CYP1A2 P05177 2/20 0.37
DHFR P00374 1/20 0.36

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
SCHEMBL8778596 0.89 HPGD (0.47) HTTSMN1; SMN2MEN1ALDH1A1PPP1CA
SCHEMBL3786284 0.88 GRM5 (0.52) HTTSMN1; SMN2MEN1PPP1CAKMT2A
SCHEMBL8778654 0.87 SMN1; SMN2 (0.52) HTTSMN1; SMN2ALDH1A1PPP1CAL3MBTL1
SCHEMBL8775116 0.79 CYP1A2 (0.47) SMN1; SMN2MEN1ALDH1A1KMT2AHPGD
SCHEMBL8778658 0.78 CYP1A2 (0.40) HTTSMN1; SMN2MEN1ALDH1A1PPP1CA
SCHEMBL8778663 0.77 ABCG2 (0.49) HTTSMN1; SMN2MEN1ALDH1A1PPP1CA
SCHEMBL8778643 0.76 ALDH1A1 (0.44) SMN1; SMN2MEN1ALDH1A1PPP1CAKMT2A
SCHEMBL8777762 0.74 USP1 (0.39) HTTSMN1; SMN2MEN1KMT2ANPC1
SCHEMBL8777404 0.74 KMT2A (0.52) HTTSMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL8515839 0.73 CYP1A2 (0.40) SMN1; SMN2MEN1ALDH1A1KMT2AGRM5

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 HTT 2814/4885SMN1; SMN2 3646/4885MEN1 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.