SCHEMBL4249329

SCHEMBL4249329

O=C(Nc1ccc(Cl)c(Cl)c1)c1ccc(Cl)c(C(F)(F)F)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.71
MAPT P10636 3/20 0.71
NPC1 O15118 3/20 0.71
MEN1 O00255 3/20 0.71
KMT2A Q03164 3/20 0.71
KDM4E B2RXH2 1/20 0.71
PKM P14618 1/20 0.71
KDR P35968 1/20 0.63
LMNA P02545 3/20 0.62
GAA P10253 2/20 0.62
GRM4 Q14833 1/20 0.58
BRAF P15056 2/20 0.57
PDK1 Q15118 1/20 0.57
HDAC3 O15379 1/20 0.57
HDAC4 P56524 1/20 0.57
HDAC1 Q13547 1/20 0.57
HDAC7 Q8WUI4 1/20 0.57
HDAC2 Q92769 1/20 0.57
HDAC10 Q969S8 1/20 0.57
HDAC11 Q96DB2 1/20 0.57

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
SCHEMBL6365067 0.87 MAPT (0.64) RAB9AMAPTNPC1MEN1KMT2A
SCHEMBL2941604 0.86 MAPT (0.64) RAB9AMAPTNPC1MEN1KMT2A
SCHEMBL11793308 0.85 KDR (0.68) RAB9AMAPTNPC1MEN1KMT2A
SCHEMBL3644090 0.85 LMNA (0.58) RAB9AMAPTMEN1KMT2AKDR
SCHEMBL4254016 0.85 NPC1 (0.71) RAB9AMAPTNPC1MEN1KMT2A
SCHEMBL4250921 0.85 MEN1 (0.58) RAB9AMAPTNPC1MEN1KMT2A
SCHEMBL3973967 0.84 KDR (0.66) RAB9AMAPTNPC1MEN1KMT2A
SCHEMBL28806101 0.84 BRAF (0.59) RAB9AMAPTMEN1KMT2AKDR
SCHEMBL17660202 0.83 MAPT (0.57) RAB9AMAPTNPC1KDM4EKDR
SCHEMBL13945777 0.83 MAPT (0.57) RAB9AMAPTMEN1KMT2AKDR

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
US-20090036420-A1 BENZAMIDE DERIVATIVES AND THEIR USE FOR TREATING CNS DISORDERS F. HOFFMANN-LA ROCHE AG (CH) 2009-02-05 US disclosed
US-20090036420-A1 BENZAMIDE DERIVATIVES AND THEIR USE FOR TREATING CNS DISORDERS F. HOFFMANN-LA ROCHE AG (CH) 2009-02-05 US disclosed
US-20090036420-A1 BENZAMIDE DERIVATIVES AND THEIR USE FOR TREATING CNS DISORDERS F. HOFFMANN-LA ROCHE AG (CH) 2009-02-05 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-20090036420-A1 BENZAMIDE DERIVATIVES AND THEIR USE FOR TREATING CNS DISORDERS GABBR1, GABBR2, CHRM2 RAB9A 733/4885MAPT 759/4885NPC1 869/4885

“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.