SCHEMBL5651158

SCHEMBL5651158

CCOc1cc(C(=O)NCCCN2CCOCC2)ccc1-c1nc2cc(Br)c(C)c(C)c2[nH]1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.53
USP2 O75604 1/20 0.53
HTT P42858 1/20 0.53
HSD17B10 Q99714 1/20 0.53
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.47
UBE2N P61088 1/20 0.47
ALDH1A1 P00352 3/20 0.46
MAPK14 Q16539 1/20 0.45
MEN1 O00255 1/20 0.44
HPGD P15428 1/20 0.44
KMT2A Q03164 1/20 0.44
KDM4E B2RXH2 1/20 0.43
GAA P10253 1/20 0.43

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
SCHEMBL5651707 0.92 CYP2D6 (0.59) TSHRUSP2HTTHSD17B10CYP2D6
SCHEMBL5652326 0.90 TSHR (0.55) TSHRUSP2HTTHSD17B10CYP2D6
SCHEMBL5650167 0.89 TSHR (0.54) TSHRUSP2HTTHSD17B10CYP2D6
SCHEMBL5651162 0.88 TSHR (0.51) TSHRUSP2HTTHSD17B10CYP2D6
SCHEMBL5651785 0.88 TSHR (0.52) TSHRUSP2HTTHSD17B10CYP2D6
SCHEMBL5649571 0.86 TSHR (0.54) TSHRUSP2HTTHSD17B10CYP2D6
SCHEMBL5652999 0.85 TSHR (0.56) TSHRHTTCYP2D6CYP2C9ALDH1A1
SCHEMBL5649910 0.85 FLT3 (0.42) KMT2A
SCHEMBL5649763 0.85 TSHR (0.52) TSHRUSP2HTTHSD17B10CYP2D6
SCHEMBL5652434 0.83 PRMT5 (0.41) HTTHSD17B10ALDH1A1KDM4EGAA

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-7220769-B2 Azolylbenzamides and analogues and their use for treating osteoporosis NIKEM RESEARCH S.R.L. (IT) 2007-05-22 US disclosed
US-20050038095-A1 Azolylbenzamides and analogues and their use for treating osteoporosis 3-V BIOSCIENCES, INC. 2005-02-17 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-20050038095-A1 Azolylbenzamides and analogues and their use for treating osteoporosis NR0B2, NR0B1, NCOR1 TSHR 161/4885USP2 2183/4885HTT 4354/4885

“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.