SCHEMBL2018905

SCHEMBL2018905

CCc1ccc(C(C)C(C)c2ccc(O)c(C(C)C(C)c3ccc(CC)c(CC)c3CC)c2C(C)C(C)c2ccc(CC)c(CC)c2CC)c(CC)c1CC

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 1/20 0.32
▸ ALOX12 P18054 1/20 0.32
▸ ESR1 P03372 1/20 0.30
▸ ESR2 Q92731 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
SCHEMBL1844370 0.88 TSHR (0.38) ALOX15ALOX12
SCHEMBL2017623 0.88 GABRA1 (0.38) ALOX15ALOX12
SCHEMBL2025112 0.79 TSHR (0.49) ALOX15ALOX12
SCHEMBL2019657 0.79 TSHR (0.41) ALOX15ALOX12ESR1ESR2
SCHEMBL2021097 0.79 PRKCI (0.36) ALOX15
SCHEMBL1843993 0.78 GABRA1 (0.40) —
SCHEMBL2018232 0.77 TYR (0.43) ALOX15
SCHEMBL1954274 0.74 ALOX15 (0.34) ALOX15ALOX12ESR1ESR2
SCHEMBL2025317 0.74 ALOX15 (0.34) ALOX15ALOX12
SCHEMBL2022483 0.74 TSHR (0.33) —

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-20110160476-A1 N-Substituted Carbamic Acid Ester Production Method and Isocyanate Production Method Using the N-Substituted Carbamic Acid Ester ASAHI KASEI CHEMICALS CORPORATION (JP) 2011-06-30 — — 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-20110160476-A1 N-Substituted Carbamic Acid Ester Production Method and Isocyanate Production Method Using the N-Substituted Carbamic Acid Ester ALKBH3, CPS1, APEH ALOX15 464/4885ALOX12 470/4885ESR1 623/4885

“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.

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