SCHEMBL8776686

SCHEMBL8776686

COc1cc(F)ccc1-c1nc(-c2ncc3ccccc3n2)ccc1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
ALDH1A1 P00352 4/20 0.38
SMN1; SMN2 Q16637 4/20 0.38
HPGD P15428 1/20 0.38
PKM P14618 2/20 0.36
CTSA P10619 1/20 0.36
MBNL1 Q9NR56 1/20 0.36
GRM5 P41594 2/20 0.36
CHRNA7 P36544 1/20 0.36
ABL1 P00519 1/20 0.36
HTT P42858 2/20 0.36
MEN1 O00255 1/20 0.36
PPP1CA P62136 1/20 0.36
KMT2A Q03164 1/20 0.36
S1PR1 P21453 1/20 0.36
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL8776454 0.91 MAOA (0.42) MAOAMAOBL3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL8776831 0.89 ALDH1A1 (0.49) MAOAMAOBALDH1A1SMN1; SMN2HPGD
SCHEMBL8776507 0.88 CRHR1 (0.43) L3MBTL1ALDH1A1SMN1; SMN2HPGDHTT
SCHEMBL8777316 0.88 MBNL1 (0.40) MAOAMAOBL3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL8776542 0.88 MBNL1 (0.40) L3MBTL1ALDH1A1SMN1; SMN2MBNL1ABL1
SCHEMBL8777019 0.86 MBNL1 (0.45) L3MBTL1ALDH1A1SMN1; SMN2HPGDMBNL1
SCHEMBL8776610 0.86 MBNL1 (0.41) L3MBTL1MBNL1ABL1
SCHEMBL8776753 0.86 MAOA (0.43) MAOAMAOBL3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL8777064 0.85 MBNL1 (0.39) L3MBTL1ALDH1A1SMN1; SMN2HPGDMBNL1
SCHEMBL8776465 0.84 MBNL1 (0.45) L3MBTL1MBNL1ABL1S1PR1NPC1

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 MAOA 737/4885MAOB 1067/4885L3MBTL1 3069/4885

“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.