SCHEMBL3477583

SCHEMBL3477583

NC(=O)Nc1[nH]c2ccc(Br)cc2c1S(=O)(=O)N1CCCC1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.41
MAPT P10636 4/20 0.40
TDP1 Q9NUW8 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
MAPK1 P28482 1/20 0.39
SIRT1 Q96EB6 1/20 0.38
ENPP2 Q13822 1/20 0.38
SIRT2 Q8IXJ6 1/20 0.38
GAA P10253 1/20 0.38
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
MITF O75030 1/20 0.37
HTT P42858 1/20 0.37
ALDH1A1 P00352 1/20 0.37
BAZ2B Q9UIF8 2/20 0.36
POLB P06746 1/20 0.36
G6PD P11413 1/20 0.36
L3MBTL1 Q9Y468 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
SCHEMBL3477282 0.89 RAB9A (0.44) LMNAMAPTTDP1SMN1; SMN2ENPP2
SCHEMBL3476253 0.88 RAB9A (0.43) LMNAMAPTTDP1SMN1; SMN2ENPP2
SCHEMBL3477116 0.85 MAPK1 (0.43) LMNAMAPTTDP1MAPK1ENPP2
SCHEMBL3477114 0.84 MAPT (0.51) LMNAMAPTSMN1; SMN2SIRT2MEN1
SCHEMBL3477657 0.84 HTT (0.44) LMNAMAPTTDP1MAPK1MEN1
SCHEMBL3477340 0.84 HRH4 (0.43) LMNAMAPTTDP1SMN1; SMN2MAPK1
SCHEMBL3477440 0.84 LMNA (0.43) LMNAMAPTTDP1SMN1; SMN2GAA
SCHEMBL3477999 0.83 EPHX2 (0.45) TDP1MAPK1MEN1KMT2AHTT
SCHEMBL3477811 0.83 KDM4E (0.44) LMNAMAPTSMN1; SMN2SIRT1GAA
SCHEMBL3606479 0.82 MAPK1 (0.43) LMNAMAPTTDP1SMN1; SMN2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100179122-A1 Non-Nucleoside Reverse Transcriptase Inhibitors MERCK SHARP & DOHME CORP. 2010-07-15 US claimed
EP-1898927-A2 NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS Merck & Co., Inc. (US) 2008-03-19 EP claimed
WO-2007002481-A2 NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS MERCK & CO., INC. (US) 2007-01-04 WO claimed

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-20100179122-A1 Non-Nucleoside Reverse Transcriptase Inhibitors RNGTT, RTF1, POLR1E LMNA 3689/4885MAPT 1105/4885TDP1 117/4885

“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.