SCHEMBL6311388

SCHEMBL6311388

O=C1c2cccc3c(N4CCCCC4)ccc(c23)C(=O)N1CO

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 13/20 0.81
KMT2A Q03164 13/20 0.81
MAPT P10636 6/20 0.81
RAB9A P51151 2/20 0.81
NPC1 O15118 1/20 0.81
AVPR1A P37288 1/20 0.81
L3MBTL1 Q9Y468 6/20 0.72
MAPK1 P28482 4/20 0.72
CRHBP P24387 2/20 0.70
CRHR2 Q13324 2/20 0.70
TDP1 Q9NUW8 2/20 0.70
HTT P42858 6/20 0.63
LMNA P02545 6/20 0.63
USP2 O75604 4/20 0.63
TLR9 Q9NR96 2/20 0.63
POLB P06746 2/20 0.63
ALDH1A1 P00352 3/20 0.60
TNNI3 P19429 1/20 0.60
TNNT2 P45379 1/20 0.60
TNNC1 P63316 1/20 0.60

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
SCHEMBL7732734 0.89 MEN1 (1.00) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL28198224 0.87 MEN1 (0.86) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL20936540 0.85 MEN1 (0.71) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL19886992 0.85 MEN1 (0.71) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL23009270 0.84 MEN1 (0.78) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL7709609 0.84 KMT2A (0.69) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL29655588 0.84 MEN1 (0.77) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL28739194 0.84 MEN1 (0.77) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL19886991 0.84 MEN1 (0.69) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL19327047 0.83 MEN1 (0.80) MEN1KMT2AMAPTRAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140336178-A1 COMPOSITIONS AND METHODS FOR MODULATING INTERACTION BETWEEN POLYPEPTIDES THE GENERAL HOSPITAL CORPORATION (US) 2014-11-13 US disclosed
US-20140336178-A1 COMPOSITIONS AND METHODS FOR MODULATING INTERACTION BETWEEN POLYPEPTIDES THE GENERAL HOSPITAL CORPORATION (US) 2014-11-13 US disclosed
US-20140336178-A1 COMPOSITIONS AND METHODS FOR MODULATING INTERACTION BETWEEN POLYPEPTIDES THE GENERAL HOSPITAL CORPORATION (US) 2014-11-13 US disclosed
US-20130203733-A1 COMPOSITIONS AND METHODS FOR MODULATING INTERACTION BETWEEN POLYPEPTIDES MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2013-08-08 US disclosed
US-20130203733-A1 COMPOSITIONS AND METHODS FOR MODULATING INTERACTION BETWEEN POLYPEPTIDES MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2013-08-08 US disclosed
US-20130203733-A1 COMPOSITIONS AND METHODS FOR MODULATING INTERACTION BETWEEN POLYPEPTIDES MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2013-08-08 US disclosed
US-8404747-B2 Compositions and methods for modulating interaction between polypeptides THE GENERAL HOSPITAL CORPORATION (US) 2013-03-26 US disclosed
US-8404747-B2 Compositions and methods for modulating interaction between polypeptides THE GENERAL HOSPITAL CORPORATION (US) 2013-03-26 US disclosed
US-8404747-B2 Compositions and methods for modulating interaction between polypeptides THE GENERAL HOSPITAL CORPORATION (US) 2013-03-26 US disclosed
US-20050239833-A1 Compositions and methods for modulating interaction between polypeptides MASSACHUSETTS INSTITUTE OF TECHNOLOGY 2005-10-27 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 (3 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-20050239833-A1 Compositions and methods for modulating interaction between polypeptides IAPP, SERPINA6, SERPINA2 MEN1 1736/4885KMT2A 4744/4885MAPT 2215/4885
US-20130203733-A1 COMPOSITIONS AND METHODS FOR MODULATING INTERACTION BETWEEN POLYPEPTIDES IAPP, SERPINA6, SERPINA2 MEN1 1736/4885KMT2A 4744/4885MAPT 2215/4885
US-20140336178-A1 COMPOSITIONS AND METHODS FOR MODULATING INTERACTION BETWEEN POLYPEPTIDES IAPP, SERPINA6, SERPINA2 MEN1 1736/4885KMT2A 4744/4885MAPT 2215/4885

“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.