SCHEMBL6768538

SCHEMBL6768538

CCN(CC)C(C)Oc1ccc(C(=C(Cl)c2ccccc2)c2ccc(O)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 11/20 0.52
EBP Q15125 4/20 0.52
KMT2A Q03164 4/20 0.52
KDM4E B2RXH2 4/20 0.52
MAPT P10636 4/20 0.52
ADORA3 P0DMS8 3/20 0.52
MEN1 O00255 3/20 0.52
NPSR1 Q6W5P4 3/20 0.52
KCNH2 Q12809 2/20 0.52
SIGMAR1 Q99720 2/20 0.52
CHRM2 P08172 2/20 0.52
ADRA2A P08913 2/20 0.52
CHRM1 P11229 2/20 0.52
PTGS1 P23219 2/20 0.52
SLC6A2 P23975 2/20 0.52
SLC6A4 P31645 2/20 0.52
DRD3 P35462 2/20 0.52
HTR6 P50406 2/20 0.52
SLC6A3 Q01959 2/20 0.52
CYP2D6 P10635 2/20 0.52

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
SCHEMBL6032890 0.95 ESR1 (0.56) ESR1EBPKMT2AKDM4EMAPT
SCHEMBL15570846 0.95 ESR1 (0.56) ESR1EBPKMT2AKDM4EMAPT
SCHEMBL4300358 0.75 KMT2A (0.61) KMT2AMAPTKCNH2ADRA2APGR
SCHEMBL15788560 0.75 ESR1 (0.90) ESR1EBPKMT2AKDM4EMAPT
4-Oh-Enclomiphene SCHEMBL14680624 0.75 ESR1 (0.90) ESR1EBPKMT2AKDM4EMAPT
SCHEMBL7602301 0.75 ESR1 (0.46) ESR1EBPKMT2AKDM4EMAPT
4-Oh-Enclomiphene SCHEMBL6768536 0.75 ESR1 (0.90) ESR1EBPKMT2AKDM4EMAPT
4-Oh-Enclomiphene SCHEMBL17152123 0.75 ESR1 (0.90) ESR1EBPKMT2AKDM4EMAPT
SCHEMBL7602287 0.75 ESR1 (0.46) ESR1EBPKMT2AKDM4EMAPT
SCHEMBL27467107 0.75 ESR1 (0.49) ESR1EBPKMT2AKDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6743784-B2 TRIARYLETHANES FOR TREATING SYMPTOMS, DISEASES AND CONDITIONS IN EXTRA-REPRODUCTIVE TRACT TISSUES, SUCH AS OSTEOPENIA, THAT ARE RESPONSIVE TO TREATMENT WITH ESTROGEN THE UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. 2004-06-01 US disclosed
US-20020045664-A1 Estrogen mimetics lacking reproductive tract effects THE UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC 2002-04-18 US disclosed
US-6323190-B1 REPRODUCTIVE TRACT TISSUES AND CARDIOVASCULAR DISORDERS THE UNIVERISTY OF GEORGIA RESEARCH FOUNDATION, INC. 2001-11-27 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-20020045664-A1 Estrogen mimetics lacking reproductive tract effects ESR2, ESRRA, GPER1 ESR1 4/4885EBP 44/4885KMT2A 1621/4885

“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.