SCHEMBL4450184

SCHEMBL4450184

O=C(Oc1ccc(-c2ccc(Cl)cc2Cl)cc1)Oc1ccc(-c2ccc(Cl)cc2Cl)cc1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 1/20 0.55
MARS1 P56192 13/20 0.49
AHR P35869 1/20 0.47
CNR1 P21554 2/20 0.42
CNR2 P34972 1/20 0.42
DAGLA Q9Y4D2 1/20 0.41

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
SCHEMBL6225651 0.88 SRD5A2 (0.62) SRD5A2MARS1AHRCNR1DAGLA
SCHEMBL2414197 0.79 SRD5A2 (0.47) SRD5A2MARS1AHRCNR1CNR2
SCHEMBL1639316 0.79 KMT2A (0.46)
SCHEMBL1637928 0.79 CYP2A6 (0.52)
SCHEMBL2933108 0.77 AHR (0.67) SRD5A2MARS1AHR
SCHEMBL56865 0.77 KMT2A (0.50)
SCHEMBL444367 0.75 SRD5A2 (0.90) SRD5A2MARS1
SCHEMBL4300785 0.75 SRD5A2 (0.68) SRD5A2MARS1AHRCNR1
SCHEMBL30837198 0.74 SRD5A2 (0.66) SRD5A2MARS1AHRCNR1CNR2
SCHEMBL16492515 0.74 SRD5A2 (0.66) SRD5A2MARS1AHRCNR1CNR2

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-7560597-B2 2′,4′-dichloro-biphenyl-4-yl-hydroxy-ketones and related compounds and their use as therapeutic agents THE UNIVERSITY COURT OF THE UNIVERSITY OF ABERDEEN (GB) 2009-07-14 US disclosed
US-7560597-B2 2′,4′-dichloro-biphenyl-4-yl-hydroxy-ketones and related compounds and their use as therapeutic agents THE UNIVERSITY COURT OF THE UNIVERSITY OF ABERDEEN (GB) 2009-07-14 US disclosed
US-7560597-B2 2′,4′-dichloro-biphenyl-4-yl-hydroxy-ketones and related compounds and their use as therapeutic agents THE UNIVERSITY COURT OF THE UNIVERSITY OF ABERDEEN (GB) 2009-07-14 US disclosed
US-20080221220-A1 2',4'-DICHLORO-BIPHENYL-4-YL-HYDROXY-KETONES AND RELATED COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS THE UNIVERSITY COURT OF THE UNIVERSITY OF ABERDEEN (GB) 2008-09-11 US disclosed
US-20080221220-A1 2',4'-DICHLORO-BIPHENYL-4-YL-HYDROXY-KETONES AND RELATED COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS THE UNIVERSITY COURT OF THE UNIVERSITY OF ABERDEEN (GB) 2008-09-11 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-20080221220-A1 2',4'-DICHLORO-BIPHENYL-4-YL-HYDROXY-KETONES AND RELATED COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS RORB, RORC, NR1H2 SRD5A2 188/4885MARS1 4662/4885AHR 195/4885

“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.