SCHEMBL7367901

SCHEMBL7367901

CCNCCN(C(C)C)C(C)C

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
CYP2C19 P33261 2/20 0.39
GLA P06280 1/20 0.39
CYP1A2 P05177 1/20 0.38
TSHR P16473 1/20 0.38
TP53 P04637 1/20 0.35
ALDH1A1 P00352 2/20 0.34
KDM1A O60341 5/20 0.32
KDM4E B2RXH2 1/20 0.32
HTT P42858 1/20 0.31
SAT1 P21673 1/20 0.30

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
SCHEMBL5932747 0.86 MEN1 (0.48) MEN1KMT2ACYP2C19ALDH1A1KDM4E
SCHEMBL172548 0.82 MEN1 (0.40) MEN1KMT2ACYP2C19TSHRALDH1A1
SCHEMBL20582715 0.78 CYP2C19 (0.35) MEN1KMT2ACYP2C19GLACYP1A2
SCHEMBL27650384 0.78 TSHR (0.46) MEN1KMT2ACYP2C19GLACYP1A2
SCHEMBL15467596 0.77 CYP2C19 (0.38) MEN1KMT2ACYP2C19GLACYP1A2
SCHEMBL22479347 0.77 MEN1 (0.40) MEN1KMT2ACYP2C19CYP1A2ALDH1A1
SCHEMBL26274264 0.77 MEN1 (0.40) MEN1KMT2ACYP2C19ALDH1A1KDM4E
SCHEMBL13996765 0.77 MEN1 (0.40) MEN1KMT2AALDH1A1KDM4E
SCHEMBL27414420 0.77
SCHEMBL24837512 0.77 MEN1 (0.36) MEN1KMT2AALDH1A1

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100374196-C Method for producing polyisocyanates BASF AG (DE) 2008-03-12 CN claimed
CN-1758956-A Method for producing polyisocyanates BASF AG (DE) 2006-04-12 CN claimed
CN-109476612-A Catalyst for curable compositions comprising hexahydrotriazine structural units SIKA技术股份公司 2019-03-15 CN disclosed
EP-2678349-B1 C-4\" POSITION SUBSTITUTED MACROLIDE DERIVATIVE TAISHO PHARMACEUTICAL CO LTD (JP) 2016-01-13 EP disclosed
US-9139609-B2 C-4″ position substituted macrolide derivative TAISHO PHARMACEUTICAL CO., LTD. (JP) 2015-09-22 US disclosed
CN-101748117-B Sample dissociation and coating of reaction surface QIAGEN GMBH 2014-03-26 CN disclosed
US-20140046043-A1 C-4\" POSITION SUBSTITUTED MACROLIDE DERIVATIVE MEIJI SEIKA PHARMA CO., LTD. (JP) 2014-02-13 US disclosed
US-20100249145-A1 Inhibitors of VEGF Receptor and HGF Receptor Signaling METHYLGENE, INC. 2010-09-30 US disclosed
US-7790729-B2 Inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE INC. (CA) 2010-09-07 US disclosed
US-20100216766-A1 Inhibitors of VEGF Receptor and HGF Receptor Signalling 92229129 QUEBEC INC. (CA) 2010-08-26 US disclosed
CN-101748117-A Sample dissociation and coating of reaction surface QIAGEN GMBH 2010-06-23 CN disclosed
CN-1758956-A Method for producing polyisocyanates BASF AG (DE) 2006-04-12 CN disclosed
CN-1675195-A Tyrosine kinase inhibitors NOVARTIS AG (CH) 2005-09-28 CN disclosed
CN-1599764-A Compounds suitable as dispersion agent for pigments BASF AG (DE) 2005-03-23 CN disclosed
US-5618814-A Trisubstituted pyrimido [5,4-d] pyrimidines for modulating multi-drug resistance and pharmaceutical compositions containing these compounds DR. KARL THOMAE GMBH (DE) 1997-04-08 US disclosed
US-5348953-A Elastase inhibitor MERCK & CO., INC. (US) 1994-09-20 US disclosed
WO-1994013636-A1 NEW SUBSTITUTED AZETIDINONES AS ANTI-INFLAMMATORY AND ANTIDEGENERATIVE AGENTS MERCK & CO., INC. (US) 1994-06-23 WO disclosed
EP-0525973-A2 Substituted azetidinones as anti-inflammatory and antidegenerative agents MERCK & CO. INC. (US) 1993-02-03 EP disclosed
WO-1993000332-A1 SUBSTITUTED AZETIDINONES AS ANTI-INFLAMMATORY AND ANTIDEGENERATIVE AGENTS MERCK & CO., INC. (US) 1993-01-07 WO disclosed
CN-1043700-A The compound that is used for the treatment of the urinary incontinence PHARMACIA AB (SE) 1990-07-11 CN 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-20100249145-A1 Inhibitors of VEGF Receptor and HGF Receptor Signaling HGF, MET, FLT1 MEN1 3655/4885KMT2A 3391/4885CYP2C19 4590/4885
US-20100216766-A1 Inhibitors of VEGF Receptor and HGF Receptor Signalling HGF, MET, FLT1 MEN1 3623/4885KMT2A 3438/4885CYP2C19 4595/4885
US-20140046043-A1 C-4\" POSITION SUBSTITUTED MACROLIDE DERIVATIVE MRPL21, MRPS34, MRPL37 MEN1 1302/4885KMT2A 3170/4885CYP2C19 508/4885

“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.