SCHEMBL18376352

SCHEMBL18376352

O=C(NCCN1CCCCC1)c1ccc(Sc2ccc(F)cc2)c([N+](=O)[O-])c1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.62
SMN1; SMN2 Q16637 4/20 0.62
MEN1 O00255 3/20 0.62
KMT2A Q03164 3/20 0.62
KDM4E B2RXH2 1/20 0.62
LMNA P02545 3/20 0.61
L3MBTL1 Q9Y468 5/20 0.56
ALDH1A1 P00352 4/20 0.56
RAB9A P51151 1/20 0.54
CACNA1G O43497 2/20 0.51
HTT P42858 2/20 0.50
MAPK1 P28482 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
HTR3A P46098 1/20 0.48
GAA P10253 1/20 0.48
TDP1 Q9NUW8 1/20 0.47

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
SCHEMBL18376419 0.99 MAPT (0.63) MAPTSMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL18376354 0.91 MAPT (0.61) MAPTSMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL18376279 0.91 MAPT (0.59) MAPTSMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL18376420 0.91 MAPT (0.75) MAPTSMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL18779430 0.90 ALDH1A1 (0.62) MAPTSMN1; SMN2MEN1KMT2AKDM4E
Hydrochloric Acid SCHEMBL18763561 0.90 MAPT (0.73) MAPTSMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL18779401 0.89 MEN1 (0.63) MAPTSMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL18376383 0.85 LMNA (0.84) MAPTSMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL18763563 0.85 MAPT (0.55) MAPTSMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL18779465 0.83 MAPT (0.61) MAPTSMN1; SMN2MEN1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11548894-B2 Benzamide or benzamine compounds useful as anticancer agents for the treatment of human cancers THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2023-01-10 US disclosed
US-11548894-B2 Benzamide or benzamine compounds useful as anticancer agents for the treatment of human cancers THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2023-01-10 US disclosed
US-20190263820-A1 BENZAMIDE OR BENZAMINE COMPOUNDS USEFUL AS ANTICANCER AGENTS FOR THE TREATMENT OF HUMAN CANCERS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2019-08-29 US disclosed
US-20190263820-A1 BENZAMIDE OR BENZAMINE COMPOUNDS USEFUL AS ANTICANCER AGENTS FOR THE TREATMENT OF HUMAN CANCERS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2019-08-29 US disclosed
US-10112948-B2 Benzamide or benzamine compounds useful as anticancer agents for the treatment of human cancers THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2018-10-30 US disclosed
US-20170114062-A1 BENZAMIDE OR BENZAMINE COMPOUNDS USEFUL AS ANTICANCER AGENTS FOR THE TREATMENT OF HUMAN CANCERS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2017-04-27 US disclosed
US-20170114062-A1 BENZAMIDE OR BENZAMINE COMPOUNDS USEFUL AS ANTICANCER AGENTS FOR THE TREATMENT OF HUMAN CANCERS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2017-04-27 US disclosed
US-20170114062-A1 BENZAMIDE OR BENZAMINE COMPOUNDS USEFUL AS ANTICANCER AGENTS FOR THE TREATMENT OF HUMAN CANCERS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2017-04-27 US disclosed
WO-2017007634-A1 BENZAMIDE OR BENZAMINE COMPOUNDS USEFUL AS ANTICANCER AGENTS FOR THE TREATMENT OF HUMAN CANCERS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2017-01-12 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 (4 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-10112948-B2 Benzamide or benzamine compounds useful as anticancer agents for the treatment of human cancers ACAT1, ACAT2, NPC1L1 MAPT 4323/4885SMN1; SMN2 4636/4885MEN1 603/4885
US-20190263820-A1 BENZAMIDE OR BENZAMINE COMPOUNDS USEFUL AS ANTICANCER AGENTS FOR THE TREATMENT OF HUMAN CANCERS ACAT1, ACAT2, NPC1L1 MAPT 4323/4885SMN1; SMN2 4636/4885MEN1 603/4885
US-11548894-B2 Benzamide or benzamine compounds useful as anticancer agents for the treatment of human cancers ACAT1, ACAT2, NPC1L1 MAPT 4323/4885SMN1; SMN2 4636/4885MEN1 603/4885
US-20170114062-A1 BENZAMIDE OR BENZAMINE COMPOUNDS USEFUL AS ANTICANCER AGENTS FOR THE TREATMENT OF HUMAN CANCERS ACAT1, ACAT2, NPC1L1 MAPT 4323/4885SMN1; SMN2 4636/4885MEN1 603/4885

“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.