SCHEMBL29911113

SCHEMBL29911113

COc1cc(C=O)ncc1-c1ccc(OCC2CC2)c(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KMO O15229 2/20 0.46
▸ GRM2 Q14416 8/20 0.46
▸ PDE4A P27815 1/20 0.41
▸ ERN1 O75460 1/20 0.40
▸ PDE4D Q08499 1/20 0.39
▸ ADORA2A P29274 1/20 0.39
▸ ADORA1 P30542 1/20 0.39
▸ PDE4B Q07343 2/20 0.39
▸ HPGD P15428 1/20 0.39
▸ KCNH2 Q12809 1/20 0.39

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
SCHEMBL30389775 0.78 TRPC6 (0.44) PDE4APDE4DPDE4B
SCHEMBL21284444 0.71 TRPC6 (0.70) —
SCHEMBL3721721 0.70 HPGD (0.58) KMOPDE4BHPGD
SCHEMBL30902449 0.70 HPGD (0.58) KMOPDE4BHPGD
SCHEMBL15351087 0.69 CNR2 (0.38) HPGD
SCHEMBL637014 0.69 FDPS (0.67) PDE4APDE4DPDE4BHPGD
SCHEMBL24386866 0.68 ALDH1A1 (0.40) ERN1HPGD
SCHEMBL28604786 0.68 ALDH1A1 (0.40) ERN1HPGD
SCHEMBL29952643 0.68 ALDH1A1 (0.40) ERN1HPGD
SCHEMBL29954314 0.68 ALDH1A1 (0.40) ERN1HPGD

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
EP-3752499-B1 INHIBITORS OF TRPC6 BOEHRINGER INGELHEIM INT (DE) 2024-03-27 — — EP claimed
US-11485740-B2 Inhibitors of TRPC6 BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2022-11-01 — — US claimed
EP-3752499-B1 INHIBITORS OF TRPC6 BOEHRINGER INGELHEIM INT (DE) 2024-03-27 — — EP disclosed
US-11485740-B2 Inhibitors of TRPC6 BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2022-11-01 — — 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-11485740-B2 Inhibitors of TRPC6 TRPC6, TRPC1, TRPC4 KMO 1290/4885GRM2 4040/4885PDE4A 1314/4885

“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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