SCHEMBL7465257

SCHEMBL7465257

COC(=O)Cc1ccc(N(CCCl)CCCl)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.51
CYP4A11 Q02928 1/20 0.51
LMNA P02545 4/20 0.51
ALDH1A1 P00352 4/20 0.51
SMN1; SMN2 Q16637 4/20 0.51
MAPT P10636 4/20 0.51
HIF1A Q16665 3/20 0.51
NFKB1 P19838 2/20 0.51
THPO P40225 2/20 0.51
PMP22 Q01453 2/20 0.51
HDAC6 Q9UBN7 2/20 0.51
GMNN O75496 1/20 0.51
CYP2D6 P10635 1/20 0.51
GABRA1 P14867 1/20 0.51
TSHR P16473 1/20 0.51
GABRA2 P47869 1/20 0.51
GABRB2 P47870 1/20 0.51
SLCO1B3 Q9NPD5 1/20 0.51
KMT2A Q03164 4/20 0.50
CYP3A4 P08684 3/20 0.50

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
SCHEMBL7472261 0.85 CYP4F2 (0.62) CYP4F2CYP4A11LMNAALDH1A1SMN1; SMN2
SCHEMBL7466474 0.84 LMNA (0.60) LMNAALDH1A1SMN1; SMN2MAPTHIF1A
SCHEMBL12102434 0.84 EGFR (0.49) LMNAALDH1A1SMN1; SMN2MAPTHIF1A
SCHEMBL15226692 0.82 HIF1A (0.69) LMNAALDH1A1SMN1; SMN2MAPTHIF1A
Chlorphenacyl SCHEMBL7468547 0.80 LMNA (0.66) LMNAALDH1A1SMN1; SMN2MAPTHIF1A
SCHEMBL7472387 0.80 ALDH1A1 (0.57) LMNAALDH1A1SMN1; SMN2MAPTHIF1A
SCHEMBL6595162 0.79 EGFR (0.53) LMNAALDH1A1SMN1; SMN2MAPTHIF1A
SCHEMBL12102420 0.79 HDAC6 (0.68) LMNAALDH1A1SMN1; SMN2MAPTHIF1A
SCHEMBL14383970 0.79 CYP3A4 (0.59) LMNAALDH1A1SMN1; SMN2MAPTHIF1A
SCHEMBL4113212 0.78 CYP4F2 (0.76) CYP4F2CYP4A11LMNAALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2760860-B1 NITROGEN MUSTARD DERIVATIVES EURO CELTIQUE SA (LU) 2016-11-16 EP disclosed
EP-2760860-B1 NITROGEN MUSTARD DERIVATIVES EURO CELTIQUE SA (LU) 2016-11-16 EP disclosed
US-8962855-B2 Nitrogen mustard derivatives PURDUE PHARMACEUTICAL PRODUCTS, L.P. (US) 2015-02-24 US disclosed
US-8962855-B2 Nitrogen mustard derivatives PURDUE PHARMACEUTICAL PRODUCTS, L.P. (US) 2015-02-24 US disclosed
US-8962855-B2 Nitrogen mustard derivatives PURDUE PHARMACEUTICAL PRODUCTS, L.P. (US) 2015-02-24 US disclosed
US-20140303218-A1 Nitrogen Mustard Derivatives NORTHLAKE INTERNATIONAL LLC 2014-10-09 US disclosed
US-20140303218-A1 Nitrogen Mustard Derivatives NORTHLAKE INTERNATIONAL LLC 2014-10-09 US disclosed
US-20140303218-A1 Nitrogen Mustard Derivatives NORTHLAKE INTERNATIONAL LLC 2014-10-09 US disclosed
EP-2760860-A2 NITROGEN MUSTARD DERIVATIVES Euro-Celtique S.A. (LU) 2014-08-06 EP disclosed
WO-2013049279-A2 NITROGEN MUSTARD DERIVATIVES CRYSTAL BIOPHARMACEUTICALS LLC (US) 2013-04-04 WO disclosed
WO-2013049279-A2 NITROGEN MUSTARD DERIVATIVES CRYSTAL BIOPHARMACEUTICALS LLC (US) 2013-04-04 WO disclosed
EP-0711768-B1 BENZIMIDAZOLE DERIVATIVE MITSUI CHEMICALS INC (JP) 2002-02-13 EP disclosed
US-5852011-A Benzimidazole derivatives MITSUI CHEMICALS, INC. (JP) 1998-12-22 US disclosed
EP-0711768-A1 BENZIMIDAZOLE DERIVATIVE MITSUI TOATSU CHEMICALS, Inc. (JP) 1996-05-15 EP 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-20140303218-A1 Nitrogen Mustard Derivatives IFNG, HNMT, IFNAR1 CYP4F2 1454/4885CYP4A11 1478/4885LMNA 4446/4885

“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.