SCHEMBL12813632

SCHEMBL12813632

c1ccc(CN2CCC(CC3CC3c3ccccc3)CC2)cc1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 4/20 0.61
MAOB P27338 2/20 0.61
CCR3 P51677 1/20 0.58
ACHE P22303 1/20 0.51
ALDH1A1 P00352 1/20 0.51
CXCR4 P61073 1/20 0.51
CCR5 P51681 1/20 0.51
DRD2 P14416 1/20 0.49
HTR2A P28223 1/20 0.49
SLC6A4 P31645 1/20 0.49
SCN5A Q14524 1/20 0.49
BCHE P06276 2/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
SIGMAR1 Q99720 1/20 0.49

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
SCHEMBL15424987 0.76 KDM1A (1.00) KDM1AMAOBDRD2HTR2ASLC6A4
SCHEMBL15411742 0.76 KDM1A (1.00) KDM1AMAOBDRD2HTR2ASLC6A4
SCHEMBL21101609 0.76 KDM1A (1.00) KDM1AMAOBDRD2HTR2ASLC6A4
SCHEMBL15411743 0.76 KDM1A (1.00) KDM1AMAOBDRD2HTR2ASLC6A4
SCHEMBL19513651 0.76 KDM1A (1.00) KDM1AMAOBDRD2HTR2ASLC6A4
SCHEMBL20633815 0.74 KDM1A (0.64) KDM1AMAOBACHEDRD2HTR2A
SCHEMBL2004615 0.74 CCR3 (1.00) CCR3ACHEALDH1A1MEN1KMT2A
SCHEMBL4433102 0.74 CCR3 (0.73) CCR3ACHEALDH1A1CXCR4DRD2
SCHEMBL15140944 0.74 CCR3 (0.73) CCR3ACHEALDH1A1CXCR4BCHE
SCHEMBL1002852 0.74 MEN1 (0.81) CCR3ACHECCR5DRD2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2688568-A2 CYCLOPROPYLAMINES AS LSD1 INHIBITORS GlaxoSmithKline Intellectual Property Development Limited (GB) 2014-01-29 EP claimed
WO-2012135113-A2 CYCLOPROPYLAMINES AS LSD1 INHIBITORS GLAXOSMITHKLINE LLC (US) 2012-10-04 WO claimed
US-20210100800-A1 USE OF A COMBINATIONAL THERAPY OF LSD1 INHIBITORS WITH P21 ACTIVATORS IN THE TREATMENT OF CANCER INSTITUTO EUROPEO DI ONCOLOGIA S.R.L. (IT) 2021-04-08 US disclosed
EP-2688568-A2 CYCLOPROPYLAMINES AS LSD1 INHIBITORS GlaxoSmithKline Intellectual Property Development Limited (GB) 2014-01-29 EP disclosed
WO-2012135113-A2 CYCLOPROPYLAMINES AS LSD1 INHIBITORS GLAXOSMITHKLINE LLC (US) 2012-10-04 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-20210100800-A1 USE OF A COMBINATIONAL THERAPY OF LSD1 INHIBITORS WITH P21 ACTIVATORS IN THE TREATMENT OF CANCER CDK6, KDM1B, KDM6B KDM1A 7/4885MAOB 1514/4885CCR3 3879/4885

“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.