SCHEMBL5063455

SCHEMBL5063455

O=C(Cl)c1ccc(OCCF)cc1Cl

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
THRB P10828 5/20 0.47
THRA P10827 1/20 0.47
ALDH1A1 P00352 4/20 0.43
KDM4E B2RXH2 4/20 0.42
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA9 Q16790 1/20 0.41
TSPO P30536 1/20 0.40
ATM Q13315 1/20 0.39
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
HTT P42858 1/20 0.39
RECQL P46063 1/20 0.39
POLB P06746 1/20 0.39
ACACB O00763 1/20 0.39

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
SCHEMBL10951452 0.90 THRB (0.48) THRBTHRAALDH1A1KDM4ELMNA
SCHEMBL5063442 0.87 SMN1; SMN2 (0.49) THRBTHRAALDH1A1KDM4ELMNA
SCHEMBL4689621 0.86 PARP1 (0.46) THRBTHRAALDH1A1KDM4ELMNA
SCHEMBL5068149 0.84 THRB (0.45) THRBTHRAALDH1A1KDM4ELMNA
SCHEMBL8876412 0.84 THRB (0.60) THRBTHRAALDH1A1KDM4ELMNA
SCHEMBL8875990 0.83 THRB (0.46) THRBTHRAALDH1A1KDM4ELMNA
SCHEMBL27389920 0.81 THRB (0.64) THRBTHRAHTTRECQL
SCHEMBL11706311 0.80 THRB (0.67) THRBTHRA
SCHEMBL28299220 0.80 THRB (0.67) THRBTHRA
SCHEMBL17143152 0.80 THRA (0.60) THRBTHRAALDH1A1KDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080161294-A1 Urea derivative, medicinal composition containing the same, and medicinal use of these KISSEI PHARMACEUTICAL CO., LTD. (JP) 2008-07-03 US disclosed
EP-1867639-A1 UREA DERIVATIVE, MEDICINAL COMPOSITION CONTAINING THE SAME, AND MEDICINAL USE OF THESE Kissei Pharmaceutical Co., Ltd. (JP) 2007-12-19 EP 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-20080161294-A1 Urea derivative, medicinal composition containing the same, and medicinal use of these AVPR2, UTS2R, GPR119 THRB 699/4885THRA 769/4885ALDH1A1 1758/4885

“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.