SCHEMBL21612985

SCHEMBL21612985

BC(C)C(C)c1ccccc1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.48
ACHE P22303 2/20 0.41
TSHR P16473 1/20 0.41
ACP3 P15309 1/20 0.37
SLC6A2 P23975 2/20 0.35
SLC6A4 P31645 2/20 0.35
SLC6A3 Q01959 2/20 0.35
GAA P10253 1/20 0.35
ADRA2A P08913 2/20 0.35
ADRA2B P18089 2/20 0.35
ADRA2C P18825 1/20 0.35
GABRA1 P14867 1/20 0.34
GABRB2 P47870 1/20 0.34
ALDH1A1 P00352 2/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
ADRB2 P07550 1/20 0.33
CYP2D6 P10635 2/20 0.33

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
SCHEMBL6546306 0.85 ESR1 (0.56) ESR1ACHETSHRACP3SLC6A2
SCHEMBL14647655 0.80 ESR1 (0.52) ESR1ACHETSHRACP3SLC6A2
SCHEMBL18568074 0.80 ESR1 (0.52) ESR1ACHETSHRACP3SLC6A2
SCHEMBL23249594 0.76 ESR1 (0.48) ESR1ACHETSHRACP3SLC6A2
SCHEMBL21338870 0.76 ESR1 (0.48) ESR1ACHETSHRACP3SLC6A2
SCHEMBL29721507 0.76 ESR1 (0.48) ESR1ACHETSHRACP3SLC6A2
SCHEMBL23249598 0.76 ESR1 (0.48) ESR1ACHETSHRACP3SLC6A2
SCHEMBL11000733 0.76 ESR1 (0.48) ESR1ACHETSHRACP3SLC6A2
SCHEMBL5493731 0.74 ESR1 (0.56) ESR1ACHETSHRACP3SLC6A2
SCHEMBL146510 0.74 ESR1 (0.56) ESR1ACHETSHRACP3SLC6A2

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-10525030-B2 Phenyl carbamate compound and a composition for neuroprotection comprising the same BIO-PHARM SOLUTIONS CO., LTD. (KR) 2020-01-07 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-10525030-B2 Phenyl carbamate compound and a composition for neuroprotection comprising the same CHAT, BAX, CASP3 ESR1 4250/4885ACHE 18/4885TSHR 4252/4885

“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.