SCHEMBL4296972

SCHEMBL4296972

C=CCCCC(=O)c1ccc(-c2ccc(Cl)cc2Cl)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 1/20 0.51
HPGD P15428 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
KDM4E B2RXH2 2/20 0.43
MEN1 O00255 1/20 0.43
PPARG P37231 1/20 0.43
KMT2A Q03164 1/20 0.43
NCOA2 Q15596 1/20 0.43
NCOA1 Q15788 1/20 0.43
NCOA3 Q9Y6Q9 1/20 0.43
GCG P01275 1/20 0.41
GCGR P47871 1/20 0.41
MARS1 P56192 6/20 0.40
MCHR1 Q99705 1/20 0.39
POLB P06746 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C19 P33261 1/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38

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
SCHEMBL13783721 0.92 SRD5A2 (0.54) SRD5A2HPGDSMN1; SMN2KDM4EMEN1
SCHEMBL13783720 0.83 SRD5A2 (0.56) SRD5A2SMN1; SMN2KDM4EGCGGCGR
SCHEMBL4296986 0.82 SRD5A2 (0.55) SRD5A2GCGGCGRMARS1MCHR1
SCHEMBL13783715 0.82 SRD5A2 (0.55) SRD5A2GCGGCGRMARS1MCHR1
SCHEMBL13783737 0.80 HSD17B3 (0.54) SRD5A2GCGRMARS1
SCHEMBL11757895 0.79 SRD5A2 (0.61) SRD5A2SMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL4300284 0.75 AHR (0.41) SRD5A2HPGDSMN1; SMN2KDM4EMEN1
SCHEMBL4299315 0.75 AHR (0.41) SRD5A2HPGDSMN1; SMN2KDM4EMEN1
SCHEMBL4453533 0.74 SMN1; SMN2 (0.59) HPGDSMN1; SMN2KDM4ECYP1A2NPC1
SCHEMBL13783731 0.73 TDP1 (0.50) SRD5A2HPGDSMN1; SMN2MEN1KMT2A

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 6 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
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 188/4885HPGD 2945/4885SMN1; SMN2 4263/4885

“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.