SCHEMBL7734519

SCHEMBL7734519

Cc1ccc(Oc2ccc(NC(=O)[C@@H]3C[C@@H](NC(=O)CN)CN3)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 1/20 0.42
LTA4H P09960 1/20 0.42
GALR3 O60755 1/20 0.41
ALDH1A1 P00352 3/20 0.39
LMNA P02545 2/20 0.39
HTT P42858 2/20 0.39
MMP2 P08253 1/20 0.39
MMP9 P14780 1/20 0.39
KMT2A Q03164 4/20 0.39
HPGD P15428 4/20 0.39
MEN1 O00255 3/20 0.39
MAPT P10636 2/20 0.38
FNTA P49354 1/20 0.38
FNTB P49356 1/20 0.38
PNLIP P16233 1/20 0.37
NPC1 O15118 1/20 0.37
GAA P10253 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37

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
Hydrochloric Acid SCHEMBL7731156 0.99 HDAC8 (0.43) HDAC8LTA4HGALR3ALDH1A1LMNA
SCHEMBL17770490 0.90 F13A1 (0.45) LTA4HALDH1A1HTTKMT2AHPGD
SCHEMBL21436732 0.90 F13A1 (0.45) LTA4HALDH1A1HTTKMT2AHPGD
SCHEMBL17770491 0.90 F13A1 (0.45) LTA4HALDH1A1HTTKMT2AHPGD
SCHEMBL21437023 0.89 ALDH1A1 (0.45) ALDH1A1LMNAHTTMMP2MMP9
Hydrochloric Acid SCHEMBL7722197 0.89 F13A1 (0.44) LTA4HALDH1A1HTTKMT2AHPGD
Hydrochloric Acid SCHEMBL7722189 0.89 F13A1 (0.44) LTA4HALDH1A1HTTKMT2AHPGD
SCHEMBL7727784 0.89 ALDH1A1 (0.45) ALDH1A1LMNAHTTMMP2MMP9
Hydrochloric Acid SCHEMBL7728707 0.88 ALDH1A1 (0.44) ALDH1A1LMNAHTTMMP2MMP9
SCHEMBL7722224 0.81 EPHX2 (0.43) HDAC8ALDH1A1HTTKMT2AMEN1

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 HDAC8 1601/4885LTA4H 273/4885GALR3 3329/4885
US-11419834-B2 Methods for treating diseases or infections caused by or associated with H. pylori using a halogenated salicylanilide MALT1, SI, BCL6 HDAC8 1601/4885LTA4H 273/4885GALR3 3329/4885
US-20210137948-A1 TREATMENT OF INFECTIONS CAUSED BY NEISSERIA GONOCOCCUS USING A HALOGENATED SALICYLANILIDE MGLL, NIT2, SI HDAC8 1595/4885LTA4H 1400/4885GALR3 1997/4885
US-20190328687-A1 Antibacterial Compounds SHARPIN, FDPS, BROX HDAC8 1008/4885LTA4H 643/4885GALR3 4402/4885

“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.