SCHEMBL31022693

SCHEMBL31022693

CCOCCOCCOCCOCCCOC

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 4/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ THRB P10828 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ HPGD P15428 2/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ EPHX2 P34913 1/20 0.32
▸ GAA P10253 1/20 0.31
▸ CA2 P00918 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
SCHEMBL19929272 1.00 TSHR (0.39) TSHRCYP3A4ALDH1A1THRBMEN1
SCHEMBL11995956 0.94 TSHR (0.39) TSHRCYP3A4ALDH1A1THRBMEN1
SCHEMBL31021559 0.94 THRB (0.41) TSHRCYP3A4ALDH1A1THRBMEN1
SCHEMBL5344 0.94 — —
SCHEMBL28983025 0.94 ALDH1A1 (0.43) TSHRCYP3A4ALDH1A1THRBHTT
SCHEMBL5956557 0.88 — —
SCHEMBL987113 0.88 TSHR (0.40) TSHRCYP3A4ALDH1A1THRBMEN1
SCHEMBL4424020 0.88 TSHR (0.40) TSHRCYP3A4ALDH1A1THRBMEN1
SCHEMBL10057430 0.88 ALDH1A1 (0.47) TSHRCYP3A4ALDH1A1THRBMEN1
SCHEMBL9672437 0.88 ALDH1A1 (0.47) TSHRCYP3A4ALDH1A1THRBMEN1

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-12590198-B2 Process for the decomposition of polyurethane NEVEON GERMANY GMBH (DE) 2026-03-31 — — US disclosed
US-20240301161-A1 PROCESS FOR THE DECOMPOSITION OF POLYURETHANE NEVEON GERMANY GMBH (DE) 2024-09-12 — — 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-12590198-B2 Process for the decomposition of polyurethane TRAM1, PARG, PUF60 TSHR 4387/4885CYP3A4 1043/4885ALDH1A1 538/4885
US-20240301161-A1 PROCESS FOR THE DECOMPOSITION OF POLYURETHANE PUF60, UMPS, UPP1 TSHR 4808/4885CYP3A4 1282/4885ALDH1A1 1102/4885

“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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