SCHEMBL4439764

SCHEMBL4439764

CCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC)c1ccc([N+](=O)[O-])c2nonc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.54
▸ KMT2A Q03164 3/20 0.54
▸ GSTP1 P09211 9/20 0.47
▸ KCNH2 Q12809 1/20 0.47
▸ GSTM2 P28161 8/20 0.46
▸ NPC1 O15118 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ NSD2 O96028 1/20 0.43
▸ NCOA1 Q15788 1/20 0.43
▸ NCOA3 Q9Y6Q9 1/20 0.43
▸ IDO1 P14902 3/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ TXNRD1 Q16881 1/20 0.42
▸ G6PD P11413 1/20 0.41
▸ CASP6 P55212 1/20 0.41
▸ USP2 O75604 1/20 0.41
▸ HTT P42858 1/20 0.41

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
SCHEMBL3505281 0.89 MEN1 (0.59) MEN1KMT2AGSTP1KCNH2GSTM2
SCHEMBL1076589 0.85 MEN1 (0.60) MEN1KMT2AGSTP1KCNH2GSTM2
SCHEMBL7463890 0.81 NSD2 (0.62) MEN1KMT2AGSTP1KCNH2GSTM2
SCHEMBL7467184 0.81 MEN1 (0.56) MEN1KMT2AGSTP1KCNH2GSTM2
SCHEMBL17914175 0.78 MEN1 (0.63) MEN1KMT2AGSTP1GSTM2NPC1
SCHEMBL6834711 0.77 MEN1 (0.69) MEN1KMT2AGSTP1GSTM2NPC1
SCHEMBL17571858 0.77 MEN1 (0.52) MEN1KMT2AGSTP1KCNH2GSTM2
SCHEMBL6259333 0.76 MEN1 (0.54) MEN1KMT2AGSTP1GSTM2
SCHEMBL4666212 0.75 GSTM2 (0.77) MEN1KMT2AGSTM2NPC1RAB9A
SCHEMBL19400408 0.75 GSTM2 (0.77) MEN1KMT2AGSTM2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090054532-A1 Modulators of Retinol-Retinol Binding Protein (RBP)-Transthyretin (TTR) Complex Formation SIRION THERAPEUTICS, INC. (US) 2009-02-26 — — US claimed
US-20060094063-A1 Modulators of retinol-retinol binding protein (RBP)-transthyretin (TTR) complex formation SYTERA, INC. (US) 2006-05-04 — — US claimed
EP-1660638-B1 LIPOPARTICLES COMPRISING PROTEINS, METHODS OF MAKING, AND USING THE SAME INTEGRAL MOLECULAR INC (US) 2015-12-23 — — EP disclosed
US-9213027-B2 Lipoparticles comprising proteins, methods of making, and using the same INTEGRAL MOLECULAR, INC. (US) 2015-12-15 — — US disclosed
US-20140135230-A1 Lipoparticles Comprising Proteins, Methods Of Making, And Using The Same INTEGRAL MOLECULAR, INC. (US) 2014-05-15 — — US disclosed
US-8574590-B2 Lipoparticles comprising proteins, methods of making, and using the same INTEGRAL MOLECULAR, INC. (US) 2013-11-05 — — US disclosed
US-20120238632-A1 MODULATORS OF RETINOL-RETINOL BINDING PROTEIN (RBP)-TRANSTHYRETIN (TTR) COMPLEX FORMATION REVISION THERAPEUTICS, INC. (US) 2012-09-20 — — US disclosed
US-20090054532-A1 Modulators of Retinol-Retinol Binding Protein (RBP)-Transthyretin (TTR) Complex Formation SIRION THERAPEUTICS, INC. (US) 2009-02-26 — — US disclosed
US-7432307-B2 Modulators of retinol-retinol binding protein (RBP)-transthyretin (TTR) complex formation SIRION THERAPEUTICS, INC. (US) 2008-10-07 — — US disclosed
US-20060094063-A1 Modulators of retinol-retinol binding protein (RBP)-transthyretin (TTR) complex formation SYTERA, INC. (US) 2006-05-04 — — US disclosed
US-20050123563-A1 Lipoparticles comprising proteins, methods of making, and using the same NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2005-06-09 — — 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-20090054532-A1 Modulators of Retinol-Retinol Binding Protein (RBP)-Transthyretin (TTR) Complex Formation RBP1, TTR, RBP4 MEN1 4500/4885KMT2A 4838/4885GSTP1 3209/4885
US-20120238632-A1 MODULATORS OF RETINOL-RETINOL BINDING PROTEIN (RBP)-TRANSTHYRETIN (TTR) COMPLEX FORMATION RBP1, TTR, RBP4 MEN1 4500/4885KMT2A 4838/4885GSTP1 3209/4885
US-20060094063-A1 Modulators of retinol-retinol binding protein (RBP)-transthyretin (TTR) complex formation RBP1, TTR, RBP4 MEN1 4500/4885KMT2A 4838/4885GSTP1 3209/4885

“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.

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