SCHEMBL21471638

SCHEMBL21471638

O=C(NC1CCOCC1)c1csc(C2CC2)c1

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 13/20 0.66
MAOA P21397 2/20 0.66
RCOR1 Q9UKL0 2/20 0.63
MAOB P27338 2/20 0.60
NAMPT P43490 1/20 0.43
HTT P42858 1/20 0.43
HPGDS O60760 1/20 0.41

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
SCHEMBL21471771 0.89 KDM1A (0.52) KDM1AMAOARCOR1MAOBHTT
SCHEMBL17164808 0.85 KDM1A (0.69) KDM1AMAOARCOR1MAOB
SCHEMBL17164807 0.85 KDM1A (0.69) KDM1AMAOARCOR1MAOB
Hydrochloric Acid SCHEMBL17158958 0.84 KDM1A (0.68) KDM1AMAOARCOR1MAOB
Hydrochloric Acid SCHEMBL17158925 0.84 KDM1A (0.68) KDM1AMAOARCOR1MAOB
Hydrochloric Acid SCHEMBL17158956 0.84 KDM1A (0.68) KDM1AMAOARCOR1MAOB
Hydrochloric Acid SCHEMBL17158924 0.84 KDM1A (0.68) KDM1AMAOARCOR1MAOB
SCHEMBL12124244 0.82 KDM1A (0.56) KDM1AMAOARCOR1MAOBHTT
SCHEMBL18167494 0.82 KDM1A (0.76) KDM1AMAOARCOR1MAOB
SCHEMBL18167497 0.82 KDM1A (0.76) KDM1AMAOARCOR1MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10968213-B2 Cyclopropanamine compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2021-04-06 US disclosed
US-20190315735-A1 CYCLOPROPANAMINE COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICALS CO (JP) 2019-10-17 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-20190315735-A1 CYCLOPROPANAMINE COMPOUND AND USE THEREOF KDM1A, KDM1B, KDM2A KDM1A 1/4885MAOA 493/4885RCOR1 218/4885
US-10968213-B2 Cyclopropanamine compound and use thereof KDM1A, KDM1B, KDM2A KDM1A 1/4885MAOA 493/4885RCOR1 218/4885

“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.