SCHEMBL6822384

SCHEMBL6822384

COc1ccc2c(c1)C(C)=C(Cc1cccnc1)CC2

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 11/20 0.54
CYP17A1 P05093 1/20 0.51
CYP11B2 P19099 9/20 0.46
CYP11B1 P15538 6/20 0.46
NPY5R Q15761 1/20 0.44
MIF P14174 1/20 0.43
KDM4E B2RXH2 2/20 0.43
LMNA P02545 1/20 0.43
TSHR P16473 1/20 0.43
HSD17B10 Q99714 1/20 0.43
CYP2C9 P11712 1/20 0.42
GFER P55789 1/20 0.42
GAA P10253 1/20 0.42

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
SCHEMBL6825530 0.90 CYP19A1 (0.63) CYP19A1CYP17A1CYP11B2CYP11B1MIF
SCHEMBL6825612 0.85 CYP19A1 (0.53) CYP19A1CYP17A1CYP11B2CYP11B1NPY5R
SCHEMBL6825179 0.82 TBXAS1 (0.41) CYP19A1CYP17A1CYP11B2CYP11B1MIF
SCHEMBL6825394 0.80 CYP19A1 (0.57) CYP19A1CYP17A1CYP11B2CYP11B1MIF
SCHEMBL9586677 0.79 TBXAS1 (0.47) CYP19A1CYP11B2CYP11B1GAA
SCHEMBL9587278 0.78 MKNK1 (0.43) CYP19A1CYP11B2CYP11B1LMNA
SCHEMBL9586856 0.78 KMT2A (0.47) KDM4ELMNATSHRHSD17B10GAA
Hydrochloric Acid SCHEMBL9586960 0.77 KMT2A (0.47) KDM4ELMNATSHRHSD17B10GAA
SCHEMBL6825267 0.77 P2RX7 (0.45) CYP19A1CYP17A1CYP11B2CYP11B1KDM4E
SCHEMBL6822419 0.75 MIF (0.46) CYP19A1CYP17A1CYP11B2CYP11B1MIF

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 CYP19A1 1/4885CYP17A1 3/4885CYP11B2 36/4885

“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.