SCHEMBL19370313

SCHEMBL19370313

CCC(C)(C)[C@@H]1CNCCO1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 13/20 0.39
ADRB2 P07550 1/20 0.33
HTR1A P08908 1/20 0.33
HTR2A P28223 1/20 0.33
SLC6A4 P31645 1/20 0.33
ADRA1A P35348 1/20 0.33
HTR2B P41595 1/20 0.33
SLC6A3 Q01959 1/20 0.33
SSTR4 P31391 1/20 0.33
ADRA2C P18825 1/20 0.30

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
SCHEMBL15499257 1.00 SLC6A2 (0.39) SLC6A2ADRB2HTR1AHTR2ASLC6A4
SCHEMBL20078604 0.86 SLC6A2 (0.38) SLC6A2ADRB2HTR1AHTR2ASLC6A4
SCHEMBL15496986 0.84 SLC6A2 (0.39) SLC6A2ADRB2HTR1AHTR2ASLC6A4
SCHEMBL26316830 0.83 SLC6A2 (0.36) SLC6A2ADRB2HTR1AHTR2ASLC6A4
SCHEMBL5981607 0.82 SLC6A2 (0.41) SLC6A2HTR1ASSTR4
SCHEMBL8916691 0.82 SLC6A2 (0.38) SLC6A2SSTR4
SCHEMBL6142277 0.80 SLC6A2 (0.35) SLC6A2ADRB2HTR1AHTR2ASLC6A4
SCHEMBL22081057 0.79 SLC6A2 (0.36) SLC6A2SSTR4
SCHEMBL17409968 0.79 SLC6A2 (0.39) SLC6A2ADRB2HTR1AHTR2ASLC6A4
SCHEMBL627761 0.79 SLC6A2 (0.39) SLC6A2ADRB2HTR1AHTR2ASLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170267696-A1 CERTAIN PROTEIN KINASE INHIBITORS FOCHON PHARMACEUTICALS, LTD. (CN) 2017-09-21 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 (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-20170267696-A1 CERTAIN PROTEIN KINASE INHIBITORS CDK4, CDK6, CDK2 SLC6A2 4854/4885ADRB2 4733/4885HTR1A 4137/4885

“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.