SCHEMBL20134529

SCHEMBL20134529

CN1CCC(N(C(=O)OC(C)(C)C)[C@@H]2C[C@H]2c2ccccc2)CC1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.42
SLC6A4 P31645 2/20 0.42
SLC6A3 Q01959 2/20 0.42
CHRM3 P20309 2/20 0.41
CHRM4 P08173 1/20 0.41
CHRM5 P08912 1/20 0.41
CHRM1 P11229 1/20 0.41
KDM1A O60341 3/20 0.41
MAOB P27338 1/20 0.41
GPR119 Q8TDV5 3/20 0.41
USP30 Q70CQ3 1/20 0.40
HTR2A P28223 2/20 0.40
HTR2C P28335 2/20 0.40
POLB P06746 1/20 0.39
HSD11B1 P28845 1/20 0.39
CCR5 P51681 1/20 0.38

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
SCHEMBL19026233 0.88 KDM1A (0.46) KDM1AMAOBGPR119HSD11B1CCR5
SCHEMBL18845585 0.88 KDM1A (0.43) CHRM3CHRM4CHRM5CHRM1KDM1A
SCHEMBL19025438 0.87 KDM1A (0.46) CHRM3KDM1AHSD11B1CCR5
SCHEMBL19025219 0.87 KDM1A (0.49) KDM1ACCR5
SCHEMBL21784350 0.86 KDM1A (0.50) KDM1AGPR119USP30HSD11B1
SCHEMBL19025342 0.86 KDM1A (0.50) KDM1AGPR119USP30HSD11B1
SCHEMBL21784423 0.86 KDM1A (0.50) KDM1AGPR119USP30HSD11B1
SCHEMBL21784353 0.86 KDM1A (0.50) KDM1AGPR119USP30HSD11B1
SCHEMBL23867768 0.85 KDM1A (0.41) SLC6A2SLC6A4SLC6A3CHRM3KDM1A
SCHEMBL21775670 0.85 KDM1A (0.41) SLC6A2SLC6A4SLC6A3CHRM3KDM1A

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-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 SLC6A2 3576/4885SLC6A4 3738/4885SLC6A3 3739/4885
US-20180127369-A1 LSD1 Inhibitors KDM1B, KDM1A, KDM3A SLC6A2 3576/4885SLC6A4 3738/4885SLC6A3 3739/4885

“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.