SCHEMBL7727800

SCHEMBL7727800

NCC(=O)NC1CN[C@H](C(=O)Nc2ccc(Nc3ccccc3)cc2)C1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.46
GAA P10253 5/20 0.46
GFER P55789 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
DPP4 P27487 4/20 0.44
HPGD P15428 6/20 0.39
ALDH1A1 P00352 2/20 0.39
CASP3 P42574 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
LTA4H P09960 1/20 0.39
HTT P42858 2/20 0.39
LMNA P02545 2/20 0.39
RAB9A P51151 1/20 0.39
ALOX12 P18054 1/20 0.39
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL7727810 1.00 MAPT (0.46) MAPTGAAGFERMEN1KMT2A
Hydrochloric Acid SCHEMBL7727207 0.99 MAPT (0.45) MAPTGAAGFERMEN1KMT2A
Hydrochloric Acid SCHEMBL7727195 0.99 MAPT (0.45) MAPTGAAGFERMEN1KMT2A
SCHEMBL7730864 0.89 MEN1 (0.42) MEN1KMT2ADPP4LTA4HLMNA
SCHEMBL7730867 0.89 MEN1 (0.42) MEN1KMT2ADPP4LTA4HLMNA
Hydrochloric Acid SCHEMBL7729684 0.88 MEN1 (0.41) MEN1KMT2ADPP4LTA4HLMNA
SCHEMBL17770491 0.88 F13A1 (0.45) MAPTMEN1KMT2AHPGDALDH1A1
SCHEMBL21436732 0.88 F13A1 (0.45) MAPTMEN1KMT2AHPGDALDH1A1
SCHEMBL17770490 0.88 F13A1 (0.45) MAPTMEN1KMT2AHPGDALDH1A1
Hydrochloric Acid SCHEMBL7729677 0.88 MEN1 (0.41) MEN1KMT2ADPP4LTA4HLMNA

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-11419834-B2 Methods for treating diseases or infections caused by or associated with H. pylori using a halogenated salicylanilide RHODE ISLAND HOSPITAL (US) 2022-08-23 US disclosed
US-20210137948-A1 TREATMENT OF INFECTIONS CAUSED BY NEISSERIA GONOCOCCUS USING A HALOGENATED SALICYLANILIDE UNION therapeutics A/S (DK) 2021-05-13 US disclosed
EP-3773602-A1 TREATMENT OF INFECTIONS CAUSED BY NEISSERIA GONOCOCCUS USING A HALOGENATED SALICYLANILIDE UNION therapeutics A/S (DK) 2021-02-17 EP disclosed
US-20200268693-A1 METHODS FOR TREATING DISEASES OR INFECTIONS CAUSED BY OR ASSOCIATED WITH H. PYLORI USING A HALOGENATED SALICYLANILIDE RHODE ISLAND HOSPITAL 2020-08-27 US disclosed
US-20190328687-A1 Antibacterial Compounds VICTORIA LINK LIMITED (NZ) 2019-10-31 US disclosed
WO-2019192968-A1 TREATMENT OF INFECTIONS CAUSED BY NEISSERIA GONOCOCCUS USING A HALOGENATED SALICYLANILIDE UNION therapeutics A/S (DK) 2019-10-10 WO disclosed
EP-3220919-A1 ANTIBACTERIAL COMPOUNDS Victoria Link Limited (NZ) 2017-09-27 EP disclosed
WO-2016080846-A1 ANTIBACTERIAL COMPOUNDS COPP JANINE NAOMI (NZ) 2016-05-26 WO disclosed
US-6399629-B1 PYRROLIDINES AND PIPERIDINES FOR TREATING MICROBIAL INFECTIONS BY REDUCING EXPORT OF COADMINISTERED ANTIMICROBIAL AGENT OR COMPOUND SYNTHESIZED BY MICROBES FOR THEIR GROWTH; REDUCING IN VIVO AVAILABILITY MICROCIDE PHARMACEUTICALS, INC. 2002-06-04 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 (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-20200268693-A1 METHODS FOR TREATING DISEASES OR INFECTIONS CAUSED BY OR ASSOCIATED WITH H. PYLORI USING A HALOGENATED SALICYLANILIDE MALT1, SI, BCL6 MAPT 4827/4885GAA 761/4885GFER 847/4885
US-11419834-B2 Methods for treating diseases or infections caused by or associated with H. pylori using a halogenated salicylanilide MALT1, SI, BCL6 MAPT 4827/4885GAA 761/4885GFER 847/4885
US-20210137948-A1 TREATMENT OF INFECTIONS CAUSED BY NEISSERIA GONOCOCCUS USING A HALOGENATED SALICYLANILIDE MGLL, NIT2, SI MAPT 4714/4885GAA 1946/4885GFER 626/4885
US-20190328687-A1 Antibacterial Compounds SHARPIN, FDPS, BROX MAPT 3628/4885GAA 335/4885GFER 267/4885

“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.