SCHEMBL6827633

SCHEMBL6827633

COc1ccc2c(c1)CC/C(=C/c1ccncc1)C2=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 11/20 1.00
MIF P14174 6/20 1.00
ALDH1A1 P00352 2/20 1.00
MAPT P10636 2/20 1.00
SMN1; SMN2 Q16637 2/20 1.00
LMNA P02545 1/20 1.00
CYP11B2 P19099 6/20 0.82
CYP26A1 O43174 1/20 0.73
MAPK1 P28482 1/20 0.67
ABCB1 P08183 1/20 0.66
MEN1 O00255 1/20 0.65
NPC1 O15118 1/20 0.65
RAB9A P51151 1/20 0.65
KMT2A Q03164 1/20 0.65

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
SCHEMBL6827637 1.00 CYP19A1 (1.00) CYP19A1MIFALDH1A1MAPTSMN1; SMN2
SCHEMBL6827818 0.91 CYP19A1 (1.00) CYP19A1MIFALDH1A1MAPTSMN1; SMN2
SCHEMBL6827821 0.91 CYP19A1 (1.00) CYP19A1MIFALDH1A1MAPTSMN1; SMN2
Hydrochloric Acid SCHEMBL4221062 0.89 CYP19A1 (0.97) CYP19A1MIFALDH1A1MAPTSMN1; SMN2
Hydrochloric Acid SCHEMBL4221071 0.89 CYP19A1 (0.97) CYP19A1MIFALDH1A1MAPTSMN1; SMN2
Hydrochloric Acid SCHEMBL4226482 0.89 CYP19A1 (0.97) CYP19A1MIFALDH1A1MAPTSMN1; SMN2
SCHEMBL6958968 0.89 MIF (0.85) CYP19A1MIFALDH1A1MAPTSMN1; SMN2
SCHEMBL14033508 0.86 MIF (0.81) CYP19A1MIFALDH1A1MAPTSMN1; SMN2
SCHEMBL8169116 0.86 MIF (1.00) CYP19A1MIFALDH1A1MAPTSMN1; SMN2
SCHEMBL8169114 0.86 MIF (1.00) CYP19A1MIFALDH1A1MAPTSMN1; SMN2

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-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 1/4885MIF 606/4885ALDH1A1 272/4885

“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.