SCHEMBL7633875

SCHEMBL7633875

OC1Cc2c(c3ccccc3c3ccccc23)C1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.40
IDO1 P14902 1/20 0.33
HSP90AA1 P07900 1/20 0.33
BRD3 Q15059 1/20 0.32
HPRT1 P00492 1/20 0.32
AR P10275 1/20 0.32
TRPM4 Q8TD43 1/20 0.31
TRPV1 Q8NER1 1/20 0.30
KDM4E B2RXH2 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
SCHEMBL7634193 0.85 EP300 (0.36) ACHETRPV1KDM4E
SCHEMBL7633997 0.74 HPRT1 (0.32) HPRT1
SCHEMBL29728630 0.69 IDO1 (0.46) IDO1
SCHEMBL73467 0.69 IDO1 (0.46) IDO1
SCHEMBL21065416 0.69
SCHEMBL15466319 0.67 HPRT1 (0.40) IDO1HPRT1TRPM4
Hydrochloric Acid SCHEMBL4151874 0.67 ANPEP (0.48) IDO1
Ammonia Solution, Strong SCHEMBL7301670 0.67 IDO1 (0.44) IDO1
SCHEMBL24228654 0.66 ACHE (0.30) ACHE
SCHEMBL21096083 0.65 KDM4E (0.41) KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6417405-B2 Synthesis of cyclopentadiene or substituted cyclopentadiene compounds THE DOW CHEMICAL COMPANY 2002-07-09 US disclosed
US-20020002308-A1 Synthesis of 4-ketocyclopentene and cyclopentadiene compounds DOW CHEMICAL COMPANY, THE 2002-01-03 US disclosed
EP-1159245-A1 SYNTHESIS OF 4-KETOCYCLOPENTENE AND CYCLOPENTADIENE COMPOUNDS THE DOW CHEMICAL COMPANY (US) 2001-12-05 EP disclosed
US-6310256-B1 REDUCING 1-CARBOHYDROCARBYLOXY-2-KETO-4-HYDROXY-5-CYCLOPENTENE COMPOUND BY CONTACTING WITH ZINC AND DECARBOXYLATING THE RESULTING REACTION PRODUCT BY CONTACTING THE REACTION MIXTURE WITH A MIXTURE OF AN ORGANIC ACID AND INORGANIC HALIDE THE DOW CHEMICAL COMPANY 2001-10-30 US disclosed
WO-2000051958-A1 SYNTHESIS OF 4-KETOCYCLOPENTENE AND CYCLOPENTADIENE COMPOUNDS THE DOW CHEMICAL COMPANY (US) 2000-09-08 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-20020002308-A1 Synthesis of 4-ketocyclopentene and cyclopentadiene compounds ADH1C, ADH1A, ADH5 ACHE 3518/4885IDO1 1513/4885HSP90AA1 2335/4885

“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.