SCHEMBL6201559

SCHEMBL6201559

ClCC(OCCBr)c1ccc(Br)cc1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 2/20 0.35
CHRM2 P08172 1/20 0.35
HTR1A P08908 1/20 0.35
ADRA2A P08913 1/20 0.35
CHRM1 P11229 1/20 0.35
DRD1 P21728 1/20 0.35
TBXA2R P21731 1/20 0.35
SLC6A2 P23975 1/20 0.35
OPRM1 P35372 1/20 0.35
DRD3 P35462 1/20 0.35
SLC6A3 Q01959 1/20 0.35
HTR2A P28223 1/20 0.32
LMNA P02545 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL8465860 0.78 HTR2A (0.38) SLC6A4CHRM2HTR1AADRA2ACHRM1
SCHEMBL10580002 0.69 LMNA (0.60) SLC6A4CHRM2HTR1AADRA2ACHRM1
SCHEMBL28858474 0.65 HTR2A (0.40) HTR2AALDH1A1
SCHEMBL29048894 0.63 SLC6A2 (0.33) SLC6A4CHRM2HTR1AADRA2ACHRM1
SCHEMBL25159737 0.63 IGF1R (0.45) HTR2A
SCHEMBL3721488 0.63 IGF1R (0.45) HTR2A
SCHEMBL2238553 0.63 IGF1R (0.45) HTR2A
SCHEMBL28429811 0.63 SLC6A4 (0.38) SLC6A4CHRM2HTR1AADRA2ACHRM1
SCHEMBL8250967 0.63 SLC6A4 (0.38) SLC6A4CHRM2HTR1AADRA2ACHRM1
SCHEMBL7634181 0.63 SLC6A2 (0.47) SLC6A4CHRM2HTR1AADRA2ACHRM1

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-1395259-A4 URAZOLE COMPOUNDS USEFUL AS ANTI-INFLAMMATORY AGENTS BRISTOL MYERS SQUIBB CO (US) 2005-01-26 EP disclosed
EP-1395259-A2 URAZOLE COMPOUNDS USEFUL AS ANTI-INFLAMMATORY AGENTS Bristol-Myers Squibb Company (US) 2004-03-10 EP disclosed
US-6673825-B2 ANTIINFLAMMATORY AGENTS; IMMUNOSUPPRESSANTS BRISTOL-MYERS SQUIBB CO. 2004-01-06 US disclosed
US-20030013745-A1 Urazole compounds useful as anti-inflammatory agents CEREP SA (FR) 2003-01-16 US disclosed
WO-2002094186-A2 URAZOLE COMPOUNDS USEFUL AS ANTI-INFLAMMATORY AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 2002-11-28 WO 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-20030013745-A1 Urazole compounds useful as anti-inflammatory agents TPMT, IL4, IL5 SLC6A4 2998/4885CHRM2 1924/4885HTR1A 2551/4885

“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.