SCHEMBL4356392

SCHEMBL4356392

O=C(NCc1ccc(F)cc1)c1nn2c(c1OCc1ccccc1)C(=O)NCCC2

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.43
KMT2A Q03164 1/20 0.40
THRB P10828 1/20 0.40
MERTK Q12866 1/20 0.40
ALDH1A1 P00352 2/20 0.39
PTGER4 P35408 1/20 0.39
EGLN1 Q9GZT9 1/20 0.39
SGMS2 Q8NHU3 1/20 0.39
TP53 P04637 2/20 0.39
PRKAA2 P54646 1/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL4199776 0.83 KDM4E (0.37) L3MBTL1SMN1; SMN2ALDH1A1RAB9A
SCHEMBL4202514 0.82 THRB (0.46) LMNAL3MBTL1SMN1; SMN2THRBMERTK
SCHEMBL4199689 0.81 USP2 (0.43) LMNAMAPTSMN1; SMN2KMT2AALDH1A1
SCHEMBL4199047 0.78 SMN1; SMN2 (0.46) LMNAMAPTL3MBTL1SMN1; SMN2KMT2A
SCHEMBL18632628 0.77 ALOX5 (0.38) KMT2AALDH1A1
SCHEMBL4198610 0.75 USP2 (0.44) LMNAMAPTSMN1; SMN2KMT2AALDH1A1
SCHEMBL14566966 0.75 LMNA (0.48) LMNAMAPTL3MBTL1SMN1; SMN2KMT2A
SCHEMBL4197420 0.72 SMN1; SMN2 (0.46) LMNAMAPTL3MBTL1SMN1; SMN2KMT2A
SCHEMBL4201415 0.71 MEN1 (0.48) LMNAL3MBTL1SMN1; SMN2KMT2ATHRB
SCHEMBL2207485 0.70 L3MBTL1 (0.45) LMNAMAPTL3MBTL1SMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1758585-A4 HIV INTEGRASE INHIBITORS MERCK & CO INC (US) 2009-07-22 EP disclosed
US-7476666-B2 HIV integrase inhibitors MERCK & CO., INC. (US) 2009-01-13 US disclosed
US-20080015187-A1 Hiv Integrase Inhibitors MERCK SHARP & DOHME CORP. 2008-01-17 US disclosed
EP-1758585-A2 HIV INTEGRASE INHIBITORS Merck & Co., Inc. (US) 2007-03-07 EP disclosed
WO-2005120516-A2 HIV INTEGRASE INHIBITORS MERCK & CO., INC. (US) 2005-12-22 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-20080015187-A1 Hiv Integrase Inhibitors REV1, ZC3HAV1, PNP LMNA 3087/4885MAPT 3777/4885L3MBTL1 692/4885

“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.