SCHEMBL8779228

SCHEMBL8779228

Cc1ccc(-c2ncc3ccc(Cl)cc3n2)nc1-c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ ADORA1 P30542 1/20 0.39
▸ DHODH Q02127 2/20 0.39
▸ RAB9A P51151 3/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ MAPK1 P28482 2/20 0.39
▸ HTT P42858 1/20 0.39
▸ KDM4E B2RXH2 4/20 0.38
▸ POLB P06746 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ PDE10A Q9Y233 1/20 0.38
▸ MAT2A P31153 1/20 0.38
▸ AURKA O14965 1/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.38
▸ GAA P10253 2/20 0.37
▸ LMNA P02545 1/20 0.37

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
SCHEMBL8779053 0.90 PDE10A (0.41) L3MBTL1ADORA1DHODHRAB9ANPC1
SCHEMBL8779396 0.87 KDM4E (0.47) L3MBTL1ADORA1RAB9ANPC1KDM4E
SCHEMBL8776930 0.85 CYP1A2 (0.48) L3MBTL1ADORA1RAB9ANPC1HTT
SCHEMBL8776938 0.84 PDE10A (0.51) L3MBTL1RAB9ANPC1KDM4EPOLB
SCHEMBL8777123 0.84 PDE10A (0.44) PDE10ANR1I3
SCHEMBL8777140 0.82 CYP1A2 (0.50) DHODHRAB9ANPC1KDM4EPOLB
SCHEMBL8776962 0.81 CYP1A2 (0.44) ADORA1RAB9ANPC1HTTALDH1A1
SCHEMBL8776925 0.80 CYP1A2 (0.38) L3MBTL1RAB9ANPC1HTTKDM4E
SCHEMBL3789195 0.80 KDM4E (0.47) L3MBTL1ADORA1DHODHRAB9ANPC1
SCHEMBL31325776 0.79 NPC1 (0.51) L3MBTL1ADORA1RAB9ANPC1MAPK1

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 3 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

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 3069/4885ADORA1 1813/4885DHODH 322/4885

“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.

Send feedback