SCHEMBL7969160

SCHEMBL7969160

C=C(C)c1ccc(C2(C)NC(=O)NC2=O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
LMNA P02545 1/20 0.47
TNKS O95271 1/20 0.43
MMP2 P08253 2/20 0.39
MMP9 P14780 2/20 0.39
ADAM17 P78536 1/20 0.35
AKR1B1 P15121 1/20 0.35
CACNA1F O60840 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
CYP2C9 P11712 1/20 0.33
HTR2A P28223 1/20 0.33
HRH1 P35367 1/20 0.33
SCN1A P35498 1/20 0.33
SCN4A P35499 1/20 0.33
BLM P54132 1/20 0.33
PMP22 Q01453 1/20 0.33
CACNA1D Q01668 1/20 0.33
KCNH2 Q12809 1/20 0.33

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
SCHEMBL20134880 0.81 MEN1 (0.55) MEN1KMT2ALMNATNKSMMP2
SCHEMBL4308515 0.81 MEN1 (0.55) MEN1KMT2ALMNATNKSMMP2
SCHEMBL20134878 0.80 LMNA (0.53) MEN1KMT2ALMNATNKSMMP2
SCHEMBL542561 0.80 LMNA (0.53) MEN1KMT2ALMNATNKSMMP2
SCHEMBL7645391 0.79 MMP2 (0.33) MEN1KMT2AMMP2MMP9AKR1B1
Hydrochloric Acid SCHEMBL8524650 0.78 KMT2A (0.55) MEN1KMT2ALMNATNKSMMP2
Hydrochloric Acid SCHEMBL8476327 0.78 KMT2A (0.55) MEN1KMT2ALMNATNKSMMP2
Hydrochloric Acid SCHEMBL8477570 0.78 KMT2A (0.55) MEN1KMT2ALMNATNKSMMP2
SCHEMBL17054772 0.75 MEN1 (0.55) MEN1KMT2ALMNATNKSMMP2
SCHEMBL10131744 0.75 LMNA (0.51) MEN1KMT2ALMNATNKSMMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6294185-B1 STABLE, INSOLUBLE BIOCIDES WHICH RELEASE ONLY SMALL AMOUNTS OF FREE HALOGEN,DISINFECTANTS AUBURN UNIVERSITY 2001-09-25 US claimed
US-5808089-A BIOCIDES AUBURN UNIVERSITY (US) 1998-09-15 US claimed
WO-1996008949-A2 NOVEL MONOMERIC AND POLYMERIC CYCLIC AMINE AND N-HALAMINE COMPOUNDS AUBURN UNIVERSITY (US) 1996-03-28 WO claimed
US-20170240435-A1 POLYMERIC HYBRID PARTICLE CONTAINING NANO PARTICLES AND USES HALOSOURCE, INC. (US) 2017-08-24 US disclosed
EP-3206496-A1 POLYMERIC HYBRID PARTICLE CONTAINING NANO PARTICLES AND USES Halosource, Inc. (US) 2017-08-23 EP disclosed
WO-2016061265-A1 POLYMERIC HYBRID PARTICLE CONTAINING NANO PARTICLES AND USES HALOSOURCE, INC. (US) 2016-04-21 WO disclosed
US-6294185-B1 STABLE, INSOLUBLE BIOCIDES WHICH RELEASE ONLY SMALL AMOUNTS OF FREE HALOGEN,DISINFECTANTS AUBURN UNIVERSITY 2001-09-25 US disclosed
US-6020491-A Monomeric and polymeric cyclic amine and N-halamine compounds AUBURN UNIVERSITY (US) 2000-02-01 US disclosed
US-5889130-A DEPOLYMERIZING OF POLY-4-VINYLACETOPHENONE FORMING 4-VINYLPHENYL(HYDANTOIN OR TRIAZINE); POLYMERIZING AUBURN UNIVERSITY (US) 1999-03-30 US disclosed
US-5808089-A BIOCIDES AUBURN UNIVERSITY (US) 1998-09-15 US disclosed
US-5670646-A HEATING POLYVINYLACETOPHENONE UNDER VACUUM TO CRACK IT TO CORRESPONDING MONOMER, CONVERTING ACETO MOIETY TO HYDANTOIN OR TRIAZINE-2,4-DIONE AUBURN UNIVERSITY (US) 1997-09-23 US disclosed
WO-1996008949-A2 NOVEL MONOMERIC AND POLYMERIC CYCLIC AMINE AND N-HALAMINE COMPOUNDS AUBURN UNIVERSITY (US) 1996-03-28 WO disclosed
US-5490983-A DISINFECTANTS AUBURN UNIVERSITY (US) 1996-02-13 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 (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-20170240435-A1 POLYMERIC HYBRID PARTICLE CONTAINING NANO PARTICLES AND USES DNMT1, DNMT3A, PUF60 MEN1 2050/4885KMT2A 170/4885LMNA 3373/4885

“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.