SCHEMBL3618243

SCHEMBL3618243

O=C(O)Nc1ccccc1NC(=O)c1ccc(-c2ncccc2Cl)cc1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 7/20 0.60
NPC1 O15118 5/20 0.54
RAB9A P51151 5/20 0.54
MAPT P10636 2/20 0.54
MEN1 O00255 2/20 0.54
LMNA P02545 2/20 0.54
KMT2A Q03164 2/20 0.54
HPGD P15428 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
HDAC1 Q13547 1/20 0.52
GRM4 Q14833 1/20 0.48
KDR P35968 2/20 0.48
GAA P10253 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
P4HTM Q9NXG6 1/20 0.48
TRPV4 Q9HBA0 1/20 0.48

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
SCHEMBL14083478 0.91 TRPV1 (0.64) TRPV1NPC1RAB9AMAPTMEN1
SCHEMBL14083473 0.87 TRPV1 (0.60) TRPV1NPC1RAB9AMAPTMEN1
SCHEMBL14083508 0.87 RAB9A (0.70) TRPV1NPC1RAB9AMAPTMEN1
SCHEMBL3613429 0.86 HDAC1 (0.69) TRPV1NPC1RAB9AHDAC1
SCHEMBL14083483 0.86 MEN1 (0.67) TRPV1NPC1RAB9AMAPTMEN1
SCHEMBL14083467 0.85 TRPV1 (0.75) TRPV1NPC1RAB9ALMNASMN1; SMN2
SCHEMBL3617701 0.85 TRPV1 (0.53) TRPV1NPC1RAB9AMEN1KMT2A
SCHEMBL4891758 0.84 TRPV1 (0.55) TRPV1NPC1RAB9AMAPTMEN1
SCHEMBL14083476 0.83 KMT2A (0.59) TRPV1RAB9AMAPTMEN1LMNA
SCHEMBL14083474 0.83 HDAC1 (0.69) TRPV1NPC1RAB9AMAPTMEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100075942-A1 N-PHENYL-4-PYRIDIN-2-YL-BENZAMIDE DERIVATIVES AS HISTONE DEACYLASE (HDAC) INHIBITORS FOR THE TREATMENT OF CANCER ASTRAZENECA AB 2010-03-25 US disclosed
WO-2006075160-A1 N-PHENYL-4-PYRIDIN-2-YL-BENZAMIDE DERIVATIVES AS HISTONE DEACYLASE (HDAC) INHIBITORS FOR THE TREATMENT OF CANCER ASTRAZENECA AB (SE) 2006-07-20 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-20100075942-A1 N-PHENYL-4-PYRIDIN-2-YL-BENZAMIDE DERIVATIVES AS HISTONE DEACYLASE (HDAC) INHIBITORS FOR THE TREATMENT OF CANCER HDAC1, HDAC2, HDAC3 TRPV1 2925/4885NPC1 3646/4885RAB9A 3314/4885

“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.