SCHEMBL29686607

SCHEMBL29686607

Cc1cc(C2OCCO2)cc(Cl)c1F

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.31
RAB9A P51151 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL15985674 0.75 CYP11B1 (0.36) RAB9AMEN1KMT2A
SCHEMBL6058540 0.72
SCHEMBL24495510 0.70 SLC6A2 (0.44) RAB9AMEN1KMT2A
SCHEMBL21140944 0.70 HTR2A (0.46) RAB9AMEN1KMT2A
SCHEMBL20083542 0.70 CYP11B1 (0.37) MEN1KMT2A
SCHEMBL3048910 0.69 MEN1 (0.40) RAB9AMEN1KMT2A
SCHEMBL31681610 0.68 CYP11B1 (0.38) RAB9AMEN1KMT2A
SCHEMBL16623130 0.68 CYP11B1 (0.38) RAB9AMEN1KMT2A
SCHEMBL335593 0.68 CHRNB2 (0.38) RAB9A
SCHEMBL6058835 0.68 TSHR (0.40) RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240043400-A1 Octahydroisoquinolinyl Derivatives UCB Biopharma SRL (BE) 2024-02-08 US disclosed
EP-4267555-A1 OCTAHYDROISOQUINOLINYL DERIVATIVES UCB Biopharma SRL (BE) 2023-11-01 EP disclosed
CN-116507332-A Octahydroisoquinolinyl derivatives UCB生物制药有限责任公司 2023-07-28 CN disclosed
WO-2022117678-A1 OCTAHYDROISOQUINOLINYL DERIVATIVES UCB Biopharma SRL (BE) 2022-06-09 WO 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-20240043400-A1 Octahydroisoquinolinyl Derivatives OPRD1, OPRK1, OPRL1 TRPA1 1228/4885RAB9A 1870/4885MEN1 3253/4885

“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.