SCHEMBL4257380

SCHEMBL4257380

CCCNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1

nearest known ligand 0.71

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 1/20 0.60
HCAR3 P49019 1/20 0.55
TP53 P04637 1/20 0.52
MAPT P10636 1/20 0.52
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
ALDH1A1 P00352 2/20 0.51
POLB P06746 1/20 0.51
LMNA P02545 1/20 0.51
CA12 O43570 1/20 0.51
CA1 P00915 1/20 0.51
CA9 Q16790 1/20 0.51

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
SCHEMBL4247187 0.93 P4HTM (0.58) P4HTMHCAR3TP53MAPTMEN1
SCHEMBL4248558 0.91 P4HTM (0.62) P4HTMHCAR3NPC1RAB9AMEN1
SCHEMBL4249317 0.89 HCAR3 (0.59) P4HTMHCAR3TP53MAPTNPC1
SCHEMBL8082051 0.86 HCAR3 (0.49) P4HTMHCAR3TP53MAPTMEN1
SCHEMBL4253868 0.84 P4HTM (0.67) P4HTMNPC1RAB9AMEN1KMT2A
SCHEMBL4247747 0.83 P4HTM (0.53) P4HTMTP53MAPTNPC1RAB9A
SCHEMBL3646298 0.83 P4HTM (0.62) P4HTMTP53MAPTNPC1RAB9A
SCHEMBL4253871 0.81 P4HTM (0.62) P4HTMHCAR3TP53NPC1RAB9A
SCHEMBL12978192 0.81 TRPV1 (0.60) HCAR3NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL15096733 0.80 HCAR3 (0.57) HCAR3TP53MAPTNPC1RAB9A

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 P4HTM 2004/4885HCAR3 295/4885TP53 4869/4885

“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.