SCHEMBL1663641

SCHEMBL1663641

O=C(O)c1ccc(N2CCN(CCCO)CC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 6/20 0.54
HTR2A P28223 3/20 0.54
KCNH2 Q12809 1/20 0.51
KDM4E B2RXH2 1/20 0.51
HTR1A P08908 4/20 0.50
DRD4 P21917 3/20 0.50
DRD3 P35462 2/20 0.50
USP2 O75604 1/20 0.50
HTR2C P28335 1/20 0.50
HRH1 P35367 1/20 0.50
HTR7 P34969 1/20 0.50
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
CYP2D6 P10635 1/20 0.47

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
SCHEMBL63379 0.90 KDM4E (0.54) DRD2HTR2AKCNH2KDM4EHTR1A
SCHEMBL27918278 0.86 MEN1 (0.51) DRD2HTR2AKCNH2HTR1ADRD4
SCHEMBL4238787 0.86 KDM4E (0.56) DRD2HTR2AKCNH2KDM4EHTR1A
SCHEMBL1280837 0.85 KDM4E (0.62) DRD2HTR2AKCNH2KDM4EHTR1A
SCHEMBL10899538 0.84 DRD2 (0.50) DRD2HTR2AKCNH2KDM4EHTR1A
SCHEMBL10901038 0.84 KDM4E (0.65) DRD2KCNH2KDM4EUSP2
SCHEMBL4187481 0.84 KDM4E (0.65) DRD2KCNH2KDM4EUSP2
SCHEMBL23221239 0.83 CYP2D6 (0.53) DRD2HTR2AKDM4EHTR1AUSP2
SCHEMBL1305865 0.83 DRD2 (0.65) DRD2KDM4EHTR1AUSP2MEN1
SCHEMBL10900407 0.82 SIGMAR1 (0.73) DRD2HTR2AHTR1AHTR2CHTR7

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-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
CN-103282034-A Use of hematopoietic growth factor mimetics LIGAND PHARM INC 2013-09-04 CN 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 DRD2 4788/4885HTR2A 4409/4885KCNH2 4861/4885
US-20150252043-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES MPL, CSF3R, HGF DRD2 4761/4885HTR2A 2334/4885KCNH2 4762/4885
US-20120295904-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES MPL, CSF3R, HGF DRD2 4761/4885HTR2A 2334/4885KCNH2 4762/4885

“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.