SCHEMBL6825486

SCHEMBL6825486

COc1ccc2c(c1)C=C(Cc1c[nH]cn1)CC2

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 3/20 0.41
CYP19A1 P11511 3/20 0.34
CYP11B1 P15538 2/20 0.34
CYP17A1 P05093 1/20 0.34
DRD1 P21728 2/20 0.33
DRD5 P21918 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
DRD2 P14416 1/20 0.33
DRD3 P35462 1/20 0.33

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
SCHEMBL6822438 0.90 CYP11B1 (0.45) CYP11B2CYP19A1CYP11B1CYP17A1KDM4E
Hydrochloric Acid SCHEMBL7167789 0.89 CYP11B1 (0.44) CYP11B2CYP19A1CYP11B1CYP17A1KDM4E
SCHEMBL6825510 0.75 ADRA2A (0.35) CYP11B2DRD1DRD5ALDH1A1DRD2
SCHEMBL6822421 0.75 CYP19A1 (0.50) CYP11B2CYP19A1CYP17A1KDM4EALDH1A1
SCHEMBL6825414 0.74 CYP11B2 (0.50) CYP11B2CYP19A1CYP11B1CYP17A1
Hydrochloric Acid SCHEMBL7166477 0.74 ADRA2A (0.34) CYP11B2DRD1DRD5ALDH1A1DRD2
SCHEMBL6825388 0.73 CYP19A1 (0.39) CYP11B2CYP19A1CYP17A1KDM4EALDH1A1
SCHEMBL6825052 0.72 CYP19A1 (0.61) CYP11B2CYP19A1CYP17A1KDM4EALDH1A1
SCHEMBL8533789 0.71 CYP11B2 (0.45) CYP11B2CYP19A1CYP11B1DRD1DRD5
SCHEMBL6825247 0.71 CYP19A1 (0.46) CYP11B2CYP19A1CYP17A1KDM4EALDH1A1

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
EP-1028110-B1 NOVEL DIHYDRONAPHTHALENE COMPOUNDS AND PROCESS FOR PRODUCING THE SAME DAIICHI SEIYAKU CO (JP) 2004-04-14 EP claimed
EP-1028110-B1 NOVEL DIHYDRONAPHTHALENE COMPOUNDS AND PROCESS FOR PRODUCING THE SAME DAIICHI SEIYAKU CO (JP) 2004-04-14 EP disclosed
US-6559157-B2 Excellent 17 alpha - hydroxylase/C17-20-lyase and aromatase inhibiting activity, thromboxan A2 synthesis inhibiting activity, useful as preventive and/or therapeutic agents for various male and female sex hormone dependent diseases DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2003-05-06 US disclosed
US-20020032211-A1 Novel dihydronaphthalene compounds and processes of producing the same DAIICHI PHARMACEUTICALS CO., LTD. (JP) 2002-03-14 US disclosed
EP-1028110-A1 NOVEL DIHYDRONAPHTHALENE COMPOUNDS AND PROCESS FOR PRODUCING THE SAME Yukijirushi Nyugyo Kabushiki Kaisha (JP) 2000-08-16 EP 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-20020032211-A1 Novel dihydronaphthalene compounds and processes of producing the same CYP19A1, HSD17B11, CYP17A1 CYP11B2 36/4885CYP19A1 1/4885CYP11B1 22/4885

“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.