SCHEMBL669691

SCHEMBL669691

C=CCN(CC=C)CC=CC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.42
TDP1 Q9NUW8 4/20 0.42
BLM P54132 3/20 0.42
LMNA P02545 3/20 0.42
GABRR1 P24046 2/20 0.42
GABRR2 P28476 2/20 0.42
GABRR3 A8MPY1 1/20 0.42
APEX1 P27695 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
ALDH1A1 P00352 4/20 0.37
TP53 P04637 1/20 0.36
EGLN1 Q9GZT9 1/20 0.36
EGLN3 Q9H6Z9 1/20 0.36
KDM4E B2RXH2 4/20 0.36
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
EYA2 O00167 1/20 0.35
APP P05067 1/20 0.35

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
SCHEMBL669690 1.00 TSHR (0.42) TSHRTDP1BLMLMNAGABRR1
SCHEMBL7638775 1.00 TSHR (0.42) TSHRTDP1BLMLMNAGABRR1
Hydrochloric Acid SCHEMBL668189 0.98 TSHR (0.41) TSHRTDP1BLMLMNAGABRR1
Hydrochloric Acid SCHEMBL668188 0.98 TSHR (0.41) TSHRTDP1BLMLMNAGABRR1
SCHEMBL16860061 0.82 ALDH1A1 (0.34) ALDH1A1KDM4EKMT2AMEN1SMN1; SMN2
SCHEMBL3263081 0.82 ALDH1A1 (0.36) TSHRTDP1BLMLMNAGABRR1
SCHEMBL16860063 0.82 ALDH1A1 (0.34) ALDH1A1KDM4EKMT2AMEN1SMN1; SMN2
SCHEMBL3263078 0.82 ALDH1A1 (0.36) TSHRTDP1BLMLMNAGABRR1
Bicarbonate SCHEMBL1081463 0.82 LMNA (0.44) TSHRTDP1BLMLMNAALDH1A1
Hydrochloric Acid SCHEMBL16860066 0.80 ALDH1A1 (0.33) ALDH1A1KDM4EKMT2AMEN1SMN1; 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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2253620-A1 Substituted 3-cyanoquinolines as protein tyrosine kinases inhibitors Wyeth Holdings Corporation (US) 2010-11-24 EP claimed
EP-1950201-A1 Substituted 3-cyanoquinolines as protein tyrosine kinases inhibitors Wyeth Holdings Corporation (US) 2008-07-30 EP claimed
EP-1117649-A1 SUBSTITUTED 3-CYANOQUINOLINES AS PROTEIN TYROSINE KINASES INHIBITORS American Cyanamid Company (US) 2001-07-25 EP claimed
WO-2000018740-A1 SUBSTITUTED 3-CYANOQUINOLINES AS PROTEIN TYROSINE KINASES INHIBITORS AMERICAN CYANAMID COMPANY (US) 2000-04-06 WO claimed
EP-2896612-A1 Substituted 3-cyanoquinolines as protein tyrosine kinases inhibitors Wyeth Holdings LLC (US) 2015-07-22 EP disclosed
US-8779192-B2 Process of preparing an alkylamine derivative KOLON LIFE SCIENCE, INC. 2014-07-15 US disclosed
EP-2253620-B1 SUBSTITUTED 3-CYANOQUINOLINES AS PROTEIN TYROSINE KINASES INHIBITORS WYETH HOLDINGS LLC (US) 2014-03-12 EP disclosed
US-20120046494-A1 METHOD OF PREPARING AN ALKYLAMINE DERIVATIVE KOLON LIFE SCIENCE, INC. (KR) 2012-02-23 US disclosed
EP-2253620-A1 Substituted 3-cyanoquinolines as protein tyrosine kinases inhibitors Wyeth Holdings Corporation (US) 2010-11-24 EP disclosed
EP-1950201-A1 Substituted 3-cyanoquinolines as protein tyrosine kinases inhibitors Wyeth Holdings Corporation (US) 2008-07-30 EP disclosed
EP-1117649-A1 SUBSTITUTED 3-CYANOQUINOLINES AS PROTEIN TYROSINE KINASES INHIBITORS American Cyanamid Company (US) 2001-07-25 EP disclosed
WO-2000018740-A1 SUBSTITUTED 3-CYANOQUINOLINES AS PROTEIN TYROSINE KINASES INHIBITORS AMERICAN CYANAMID COMPANY (US) 2000-04-06 WO 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-20120046494-A1 METHOD OF PREPARING AN ALKYLAMINE DERIVATIVE INMT, PNMT, ALKBH2 TSHR 1506/4885TDP1 1797/4885BLM 413/4885

“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.