SCHEMBL7722172

SCHEMBL7722172

Cc1cc(C)cc(NC(=O)[C@@H](CCc2ccccc2)NC(=O)[C@@H]2C[C@@H](NC(=O)CN)CN2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.40
MASP2 O00187 2/20 0.37
MMP8 P22894 1/20 0.37
CALCRL Q16602 1/20 0.37
F2 P00734 1/20 0.37
HDAC3 O15379 4/20 0.37
HDAC1 Q13547 4/20 0.37
HDAC2 Q92769 4/20 0.37
HDAC10 Q969S8 4/20 0.37
HDAC11 Q96DB2 4/20 0.37
HDAC8 Q9BY41 4/20 0.37
HDAC6 Q9UBN7 4/20 0.37
NCOR2 Q9Y618 1/20 0.37
KMT2A Q03164 2/20 0.36
PLAU P00749 1/20 0.36
HPN P05981 1/20 0.36
IDO1 P14902 1/20 0.36
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
CTSC P53634 1/20 0.36

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 SCHEMBL7729651 0.99 MMP2 (0.40) MMP2MASP2MMP8CALCRLF2
SCHEMBL17770546 0.90 POLB (0.41) MMP2CALCRLF2HDAC3HDAC1
Hydrochloric Acid SCHEMBL7729657 0.89 POLB (0.40) MMP2CALCRLF2HDAC3HDAC1
SCHEMBL7734309 0.88 EPHX2 (0.40) MASP2CALCRLF2HDAC3HDAC1
Hydrochloric Acid SCHEMBL7729869 0.87 EPHX2 (0.39) MASP2CALCRLF2HDAC3HDAC1
SCHEMBL7722218 0.87 MMP8 (0.37) MASP2MMP8F2CTSCNFKB1
SCHEMBL21436233 0.87 MMP8 (0.37) MASP2MMP8F2CTSCNFKB1
SCHEMBL7722316 0.86 F2 (0.36) MASP2MMP8F2HDAC3HDAC1
SCHEMBL21436517 0.86 F2 (0.36) MASP2MMP8F2HDAC3HDAC1
SCHEMBL17770534 0.85 NPC1 (0.43) CALCRLHDAC3HDAC1HDAC2HDAC10

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 MMP2 2167/4885MASP2 1439/4885MMP8 872/4885
US-11419834-B2 Methods for treating diseases or infections caused by or associated with H. pylori using a halogenated salicylanilide MALT1, SI, BCL6 MMP2 2167/4885MASP2 1439/4885MMP8 872/4885
US-20210137948-A1 TREATMENT OF INFECTIONS CAUSED BY NEISSERIA GONOCOCCUS USING A HALOGENATED SALICYLANILIDE MGLL, NIT2, SI MMP2 2457/4885MASP2 3844/4885MMP8 670/4885
US-20190328687-A1 Antibacterial Compounds SHARPIN, FDPS, BROX MMP2 360/4885MASP2 678/4885MMP8 19/4885

“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.