SCHEMBL12467495

SCHEMBL12467495

O=C(O)CN1C(=O)COc2ccc(Cl)cc21

nearest known ligand 0.76

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMO O15229 1/20 0.76
HTT P42858 2/20 0.71
TSHR P16473 2/20 0.71
USP2 O75604 1/20 0.70
ALDH1A1 P00352 1/20 0.67
THRB P10828 1/20 0.64
ALOX15 P16050 3/20 0.63
POLB P06746 2/20 0.63
MEN1 O00255 1/20 0.63
KMT2A Q03164 1/20 0.63
NPSR1 Q6W5P4 1/20 0.63
KDM4E B2RXH2 1/20 0.63
MAPT P10636 2/20 0.61
HSD17B10 Q99714 1/20 0.60
RAB9A P51151 1/20 0.58

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
SCHEMBL18259130 0.86 KMO (1.00) KMOHTTTSHRUSP2ALDH1A1
SCHEMBL7276060 0.83 TSHR (1.00) HTTTSHRALDH1A1POLBMEN1
SCHEMBL8263744 0.83 HTT (0.71) KMOHTTTSHRUSP2ALDH1A1
SCHEMBL2956116 0.83 HTT (0.63) KMOHTTTSHRUSP2ALDH1A1
SCHEMBL5346335 0.82 HTT (0.70) KMOHTTTSHRUSP2ALDH1A1
SCHEMBL12203796 0.81 USP2 (0.67) KMOHTTTSHRUSP2THRB
SCHEMBL13779978 0.80 MEN1 (0.66) KMOHTTTSHRUSP2POLB
SCHEMBL3893315 0.80 KMO (0.79) KMOHTTTSHRUSP2THRB
SCHEMBL2947181 0.80 HTT (0.70) KMOHTTTSHRUSP2ALDH1A1
SCHEMBL30808661 0.80 KMT2A (0.68) HTTTSHRUSP2ALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11078358-B2 Curable composition including epoxy resin and curable solid filler 3M INNOVATIVE PROPERTIES COMPANY (US) 2021-08-03 US disclosed
EP-3661990-A1 CURABLE COMPOSITION INCLUDING EPOXY RESIN AND CURABLE SOLID FILLER 3M Innovative Properties Company (US) 2020-06-10 EP disclosed
US-20200148878-A1 CURABLE COMPOSITION INCLUDING EPOXY RESIN AND CURABLE SOLID FILLER 3M INNOVATIVE PROPERTIES COMPANY 2020-05-14 US disclosed
CN-110997748-A Curable composition comprising an epoxy resin and a curable solid filler 3M创新有限公司 2020-04-10 CN disclosed
WO-2019027746-A1 CURABLE COMPOSITION INCLUDING EPOXY RESIN AND CURABLE SOLID FILLER 3M INNOVATIVE PROPERTIES COMPANY (US) 2019-02-07 WO disclosed
EP-2670765-B1 C-17 AND C-3 MODIFIED TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY VIIV HEALTHCARE UK (NO 4) LTD (GB) 2017-10-18 EP disclosed
US-20160151387-A1 COMPOSITIONS HAVING C-17 AND C-3 MODIFIED TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY VIIV HEALTHCARE UK (NO. 4) LIMITED (GB) 2016-06-02 US disclosed
US-20140343000-A1 COMPOSITIONS HAVING C-17 AND C-3 MODIFIED TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY VIIV HEALTHCARE UK (NO. 4) LIMITED (GB) 2014-11-20 US disclosed
US-8846647-B2 C-17 and C-3 modified triterpenoids with HIV maturation inhibitory activity BRISTOL-MYERS SQUIBB COMPANY (US) 2014-09-30 US disclosed
EP-2670765-A1 C-17 AND C-3 MODIFIED TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY Bristol-Myers Squibb Company (US) 2013-12-11 EP disclosed
US-20130035318-A1 C-17 AND C-3 MODIFIED TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY BRISTOL-MYERS SQUIBB COMPANY 2013-02-07 US disclosed
WO-2012106190-A1 C-17 AND C-3 MODIFIED TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY BRISTOL-MYERS SQUIBB COMPANY (US) 2012-08-09 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 (3 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-20130035318-A1 C-17 AND C-3 MODIFIED TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY CYP51A1, UGT2B17, CDK17 KMO 2868/4885HTT 4863/4885TSHR 4746/4885
US-20160151387-A1 COMPOSITIONS HAVING C-17 AND C-3 MODIFIED TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY CYP51A1, UGT2B17, HSD17B7 KMO 2732/4885HTT 4847/4885TSHR 4796/4885
US-20140343000-A1 COMPOSITIONS HAVING C-17 AND C-3 MODIFIED TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY CYP51A1, UGT2B17, HSD17B7 KMO 2732/4885HTT 4847/4885TSHR 4796/4885

“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.