SCHEMBL8777029

SCHEMBL8777029

COc1ccc(Cl)cc1-c1nc(-c2ncc3ccccc3n2)ccc1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.43
ALDH1A1 P00352 4/20 0.39
KDM4E B2RXH2 3/20 0.39
ALPL P05186 1/20 0.39
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
AGPAT2 O15120 2/20 0.37
KMT2A Q03164 4/20 0.37
MEN1 O00255 3/20 0.37
PPP1CA P62136 3/20 0.37
JAK2 O60674 1/20 0.37
JAK1 P23458 1/20 0.37
TYK2 P29597 1/20 0.37
JAK3 P52333 1/20 0.37
RECQL P46063 1/20 0.37
POLB P06746 3/20 0.36
KLF5 Q13887 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
SCHEMBL8776714 0.89 KMT2A (0.39) L3MBTL1ALDH1A1KDM4EALPLMAOA
SCHEMBL8776925 0.89 CYP1A2 (0.38) L3MBTL1ALDH1A1KDM4ENPC1RAB9A
SCHEMBL8776736 0.88 KDM4E (0.49) L3MBTL1ALDH1A1KDM4EALPLMAOA
SCHEMBL8776454 0.87 MAOA (0.42) L3MBTL1ALDH1A1KDM4EMAOAMAOB
SCHEMBL8776737 0.86 PDE10A (0.37) L3MBTL1ALDH1A1KDM4EALPLSMN1; SMN2
SCHEMBL8776831 0.86 ALDH1A1 (0.49) ALDH1A1KDM4EMAOAMAOBSMN1; SMN2
SCHEMBL8776807 0.85 MBNL1 (0.44) ALPLNPC1TGFBR1
SCHEMBL8776700 0.85 CRHR1 (0.41) L3MBTL1ALDH1A1KDM4ESMN1; SMN2KMT2A
SCHEMBL8777134 0.84 ALDH1A1 (0.36) L3MBTL1ALDH1A1KDM4EMAOAMAOB
SCHEMBL8776589 0.84 CRHR1 (0.41) KDM4EKMT2AMEN1MAPTLMNA

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 L3MBTL1 3069/4885ALDH1A1 1125/4885KDM4E 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.