SCHEMBL1664005

SCHEMBL1664005

O=Cc1cc(C=O)cc(NCCO)c1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
KMT2A Q03164 1/20 0.33
HTR7 P34969 1/20 0.32
POLB P06746 1/20 0.32
PKM P14618 1/20 0.32
XDH P47989 1/20 0.32
ALDH1A1 P00352 3/20 0.31
RECQL P46063 2/20 0.31
MCL1 Q07820 1/20 0.31
KDM4E B2RXH2 2/20 0.31
TSHR P16473 2/20 0.30
TDP1 Q9NUW8 1/20 0.30
PTGS2 P35354 1/20 0.30
RAB9A P51151 1/20 0.30
ABL1 P00519 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 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
SCHEMBL15652041 0.80 KDR (0.37) MAPK1MEN1GAAKMT2APOLB
SCHEMBL1825941 0.79 ALDH5A1 (0.43) MAPK1GAAKMT2AALDH1A1KDM4E
SCHEMBL22641731 0.75 DRD1 (0.44) ALDH1A1KDM4E
SCHEMBL13974152 0.75 MEN1 (0.34) MAPK1MEN1GAAKMT2APOLB
SCHEMBL13963845 0.71 MEN1 (0.32) MAPK1MEN1GAAKMT2A
SCHEMBL11092185 0.69 MAPT (0.40) MAPK1MEN1GAAKMT2AHTR7
SCHEMBL27081560 0.69 GAA (0.40) MAPK1MEN1GAAKMT2APOLB
SCHEMBL22641717 0.69 SLC1A3 (0.38) MAPK1GAAALDH1A1KDM4E
SCHEMBL11576865 0.69 BACE1 (0.40) MAPK1MEN1GAAKMT2APOLB
SCHEMBL18739206 0.69 KCNH3 (0.39) MAPK1MEN1GAAKMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9622991-B2 Hematopoietic growth factor mimetic small molecule compounds and their uses LIGAND PHARMACEUTICALS INC. (US) 2017-04-18 US disclosed
US-9144557-B2 Hematopoietic growth factor mimetic small molecule compounds and their uses LIGAND PHARMACEUTICALS INC. (US) 2015-09-29 US disclosed
US-20150252043-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES CITIBANK, N.A., AS ADMINISTRATIVE AGENT 2015-09-10 US disclosed
US-20140243324-A1 USE OF HEMATOPOIETIC GROWTH FACTOR MIMETICS LIGAND PHARMACEUTICALS INCORPORATED (US) 2014-08-28 US disclosed
EP-2642994-A2 USE OF HEMATOPOIETIC GROWTH FACTOR MIMETICS Ligand Pharmaceuticals Incorporated (US) 2013-10-02 EP disclosed
US-20120295904-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES LIGAND PHARMACEUTICALS INC. (US) 2012-11-22 US disclosed
EP-2488486-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES Ligand Pharmaceuticals Inc. (US) 2012-08-22 EP disclosed
WO-2012068406-A2 USE OF HEMATOPOIETIC GROWTH FACTOR MIMETICS LIGAND PHARMACEUTICALS INCORPORATED (US) 2012-05-24 WO disclosed
WO-2011046954-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES LIGAND PHARMACEUTICALS INC. (US) 2011-04-21 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 (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-20140243324-A1 USE OF HEMATOPOIETIC GROWTH FACTOR MIMETICS HGF, EPOR, MPL MAPK1 4003/4885MEN1 1370/4885GAA 2365/4885
US-20150252043-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES MPL, CSF3R, HGF MAPK1 1482/4885MEN1 1395/4885GAA 1915/4885
US-20120295904-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES MPL, CSF3R, HGF MAPK1 1482/4885MEN1 1395/4885GAA 1915/4885

“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.