SCHEMBL20134663

SCHEMBL20134663

CN1CCN(c2ccc(OCCN3CCC(N)CC3)cc2)C1=O

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 5/20 0.62
HRH2 P25021 2/20 0.47
HRH1 P35367 2/20 0.47
HRH3 Q9Y5N1 2/20 0.47
SIGMAR1 Q99720 1/20 0.46
LTA4H P09960 4/20 0.45
PTGS1 P23219 1/20 0.43
PTGS2 P35354 1/20 0.43
MAPK14 Q16539 1/20 0.43
KDM4E B2RXH2 2/20 0.42
HTR2A P28223 1/20 0.42
HTR2C P28335 1/20 0.42
HTR2B P41595 1/20 0.42
KCNH2 Q12809 1/20 0.42

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
SCHEMBL22065525 0.80 KDM1A (0.62) KDM1AHRH2HRH1HRH3LTA4H
SCHEMBL19047563 0.79 KDM1A (0.62) KDM1AHRH3
SCHEMBL19025184 0.78 KDM1A (1.00) KDM1A
SCHEMBL22065531 0.77 KDM1A (0.64) KDM1AHRH2HRH1HRH3LTA4H
SCHEMBL22066980 0.77 KDM1A (0.64) KDM1AHRH2HRH1HRH3LTA4H
SCHEMBL19047571 0.77 HRH3 (0.68) KDM1AHRH2HRH1HRH3SIGMAR1
SCHEMBL8301822 0.77 LMNA (0.53) KDM1A
SCHEMBL20134649 0.76 KDM1A (0.59) KDM1AHRH2HRH1HRH3SIGMAR1
SCHEMBL19091786 0.76 KDM1A (0.62) KDM1ALTA4H
SCHEMBL22066534 0.75 KDM1A (0.59) KDM1AHRH2HRH1HRH3LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3397616-B1 LSD1 INHIBITORS MIRATI THERAPEUTICS INC (US) 2020-06-10 EP disclosed
US-10233152-B2 LSD1 inhibitors Mirati Therapeutics, Inc. (US) 2019-03-19 US disclosed
US-20180127369-A1 LSD1 Inhibitors Mirati Therapeutics, Inc. 2018-05-10 US 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 (2 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-10233152-B2 LSD1 inhibitors KDM1B, KDM1A, KDM3A KDM1A 2/4885HRH2 3240/4885HRH1 2699/4885
US-20180127369-A1 LSD1 Inhibitors KDM1B, KDM1A, KDM3A KDM1A 2/4885HRH2 3240/4885HRH1 2699/4885

“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.