SCHEMBL15847845

SCHEMBL15847845

CC[C@@H](C)NS(=O)(=O)c1ccc(F)c(C(=O)O)c1

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.64
▸ LMNA P02545 3/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ SLC1A3 P43003 1/20 0.48
▸ SLC1A2 P43004 1/20 0.48
▸ SLC1A1 P43005 1/20 0.48
▸ ALDH1A1 P00352 3/20 0.46
▸ HTT P42858 2/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ WDR5 P61964 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ CNR1 P21554 1/20 0.45
▸ GPR55 Q9Y2T6 1/20 0.45
▸ KDM4E B2RXH2 1/20 0.44
▸ POLB P06746 1/20 0.44

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
SCHEMBL14485236 1.00 KMT2A (0.64) KMT2ALMNASMN1; SMN2SLC1A3SLC1A2
SCHEMBL15847548 0.90 KMT2A (0.62) KMT2ALMNASMN1; SMN2SLC1A3SLC1A2
SCHEMBL15847550 0.90 KMT2A (0.62) KMT2ALMNASMN1; SMN2SLC1A3SLC1A2
SCHEMBL17465709 0.90 KMT2A (0.62) KMT2ALMNASMN1; SMN2SLC1A3SLC1A2
SCHEMBL13543499 0.87 CYP3A4 (0.52) KMT2ALMNASLC1A3SLC1A2SLC1A1
SCHEMBL10990359 0.83 KMT2A (0.49) KMT2ALMNASMN1; SMN2ALDH1A1HTT
SCHEMBL10989857 0.83 LMNA (0.57) KMT2ALMNAALDH1A1HTTL3MBTL1
SCHEMBL15848442 0.83 KMT2A (0.66) KMT2ALMNASMN1; SMN2MAPTKDM4E
SCHEMBL14487951 0.83 KMT2A (0.66) KMT2ALMNAMAPTKDM4EPOLB
SCHEMBL15847989 0.83 KMT2A (0.66) KMT2ALMNAMAPTKDM4EPOLB

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-9938236-B2 Antiviral agents against HBV infection DREXEL UNIVERSITY (US) 2018-04-10 — — US disclosed
US-9938236-B2 Antiviral agents against HBV infection DREXEL UNIVERSITY (US) 2018-04-10 — — US disclosed
US-9938236-B2 Antiviral agents against HBV infection DREXEL UNIVERSITY (US) 2018-04-10 — — US disclosed
US-20160024004-A1 NOVEL ANTIVIRAL AGENTS AGAINST HBV INFECTION NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-01-28 — — US disclosed
US-20160024004-A1 NOVEL ANTIVIRAL AGENTS AGAINST HBV INFECTION NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-01-28 — — US disclosed
US-20160024004-A1 NOVEL ANTIVIRAL AGENTS AGAINST HBV INFECTION NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-01-28 — — US disclosed
EP-2938338-A2 NOVEL ANTIVIRAL AGENTS AGAINST HBV INFECTION Drexel University (US) 2015-11-04 — — EP disclosed
WO-2014106019-A2 NOVEL ANTIVIRAL AGENTS AGAINST HBV INFECTION PHILADELPHIA HEALTH & EDUCATION CORPORATION, D/B/A DREXEL (US) 2014-07-03 — — WO disclosed
WO-2014106019-A2 NOVEL ANTIVIRAL AGENTS AGAINST HBV INFECTION PHILADELPHIA HEALTH & EDUCATION CORPORATION, D/B/A DREXEL (US) 2014-07-03 — — 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 (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-20160024004-A1 NOVEL ANTIVIRAL AGENTS AGAINST HBV INFECTION HAVCR2, EIF2AK2, NR1H4 KMT2A 3874/4885LMNA 1478/4885SMN1; SMN2 4553/4885

“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.

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