SCHEMBL4488063

SCHEMBL4488063

Nc1ccccc1NC(=O)c1ccc(C(=O)NCCCN2CCCC2=O)cc1

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 2/20 0.63
KMT2A Q03164 1/20 0.61
SMN1; SMN2 Q16637 4/20 0.60
USP2 O75604 1/20 0.59
FSHR P23945 1/20 0.58
ALDH1A1 P00352 1/20 0.58
TSHR P16473 1/20 0.58
LMNA P02545 1/20 0.57
HPGD P15428 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.54
HDAC1 Q13547 2/20 0.53
HDAC3 O15379 1/20 0.53

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
SCHEMBL6077188 0.89 KMT2A (0.59) NAMPTKMT2ASMN1; SMN2FSHRHDAC1
SCHEMBL6385896 0.87 L3MBTL1 (0.60) NAMPTKMT2ASMN1; SMN2USP2ALDH1A1
SCHEMBL13213711 0.84 SMN1; SMN2 (0.69) NAMPTKMT2ASMN1; SMN2USP2ALDH1A1
SCHEMBL4707395 0.84 LMNA (0.75) NAMPTKMT2ASMN1; SMN2USP2ALDH1A1
SCHEMBL6076554 0.84 KMT2A (0.55) NAMPTKMT2ASMN1; SMN2USP2FSHR
SCHEMBL22874495 0.83 HDAC1 (0.58) NAMPTSMN1; SMN2ALDH1A1LMNAHDAC1
SCHEMBL212371 0.83 HDAC1 (0.56) HDAC1HDAC3
SCHEMBL6068990 0.82 SMN1; SMN2 (0.69) NAMPTKMT2ASMN1; SMN2USP2ALDH1A1
SCHEMBL9367173 0.79 LMNA (0.69) NAMPTKMT2ASMN1; SMN2USP2ALDH1A1
SCHEMBL10194836 0.79 SMN1; SMN2 (0.73) NAMPTKMT2ASMN1; SMN2USP2ALDH1A1

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
EP-1592667-A2 NEW MONO-ACYLATED O-PHENYLENDIAMINES DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2005-11-09 EP claimed
WO-2004069803-A2 MONO-ACYLATED O-PHENYLENDIAMINES DERIVATIVES AND THEIR USE AGAINST CANCER F. HOFFMANN-LA ROCHE AG (CH) 2004-08-19 WO claimed
US-20040162317-A1 Mono-acylated o-phenylendiamines derivatives F. HOFFMANN-LA ROCHE AG, A SWISS COMPANY (CH) 2004-08-19 US claimed
US-7501451-B2 Mono-acylated o-phenylendiamines derivatives HOFFMANN-LA ROCHE INC. (US) 2009-03-10 US disclosed
US-7071219-B2 Mono-acylated o-phenylendiamines derivatives HOFFMANN-LA ROCHE INC. (US) 2006-07-04 US disclosed
US-20060089403-A1 Mono-acylated o-phenylendiamines derivatives FERTIG GEORG 2006-04-27 US disclosed
EP-1592667-A2 NEW MONO-ACYLATED O-PHENYLENDIAMINES DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2005-11-09 EP disclosed
WO-2004069803-A2 MONO-ACYLATED O-PHENYLENDIAMINES DERIVATIVES AND THEIR USE AGAINST CANCER F. HOFFMANN-LA ROCHE AG (CH) 2004-08-19 WO disclosed
US-20040162317-A1 Mono-acylated o-phenylendiamines derivatives F. HOFFMANN-LA ROCHE AG, A SWISS COMPANY (CH) 2004-08-19 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 (2 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-20060089403-A1 Mono-acylated o-phenylendiamines derivatives HDAC1, HDAC10, HDAC11 NAMPT 1017/4885KMT2A 24/4885SMN1; SMN2 4107/4885
US-20040162317-A1 Mono-acylated o-phenylendiamines derivatives HDAC1, HDAC11, HDAC10 NAMPT 2040/4885KMT2A 33/4885SMN1; SMN2 4060/4885

“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.