SCHEMBL1048652

SCHEMBL1048652

ClCc1cccc(CBr)c1CBr

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
GABRA1 P14867 1/20 0.31
GABRB2 P47870 1/20 0.31

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
SCHEMBL18550415 0.95 ALDH1A1 (0.35) ALDH1A1TSHRGABRA1GABRB2
SCHEMBL1048140 0.91 ALDH1A1 (0.33) ALDH1A1TSHRGABRA1GABRB2
SCHEMBL338177 0.87 GABRA1 (0.38) ALDH1A1TSHRGABRA1GABRB2
SCHEMBL1049876 0.85
SCHEMBL15653446 0.82 TAAR1 (0.40) ALDH1A1
SCHEMBL1048345 0.81
SCHEMBL1050929 0.80 L3MBTL1 (0.30)
SCHEMBL15652995 0.77 TAAR1 (0.40)
SCHEMBL1049731 0.77 TSHR (0.41) ALDH1A1TSHR
SCHEMBL234202 0.76 TSHR (0.39) ALDH1A1TSHRGABRA1GABRB2

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
US-7863239-B2 polypeptide which is cysteine-knot growth factor family member attached to scaffold such as bis(bromomethyl)benzene; point mutations; treating infection and autoimmune disorders PEPSCAN SYSTEMS B.V. (NL) 2011-01-04 US disclosed
US-20080313749-A1 Binding Compounds, Immunogenic Compounds and Peptidomimetics PEPSCAN SYSTEMS B.V. (NL) 2008-12-18 US disclosed
EP-1844337-A1 BINDING COMPOUNDS, IMMUNOGENIC COMPOUNDS AND PEPTIDOMIMETICS PEPSCAN SYSTEMS B.V. (NL) 2007-10-17 EP disclosed
WO-2006078161-A1 BINDING COMPOUNDS, IMMUNOGENIC COMPOUNDS AND PEPTIDOMIMETICS PEPSCAN SYSTEMS B.V. (NL) 2006-07-27 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-20080313749-A1 Binding Compounds, Immunogenic Compounds and Peptidomimetics CXCL10, CCL2, CD74 ALDH1A1 4812/4885TSHR 3066/4885GABRA1 2583/4885

“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.