SCHEMBL5652326

SCHEMBL5652326

Cc1c(Br)cc2nc(-c3ccc(C(=O)NCCCN4CCOCC4)cc3Br)[nH]c2c1C

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.55
CYP2C9 P11712 2/20 0.49
MAPK14 Q16539 1/20 0.49
CYP2D6 P10635 1/20 0.49
LMNA P02545 1/20 0.46
USP2 O75604 1/20 0.46
HTT P42858 1/20 0.46
HSD17B10 Q99714 1/20 0.46
POLB P06746 1/20 0.46
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 2/20 0.45
KDM4E B2RXH2 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
GAA P10253 1/20 0.45
SMYD2 Q9NRG4 1/20 0.44

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
SCHEMBL5650167 0.94 TSHR (0.54) TSHRCYP2C9MAPK14CYP2D6LMNA
SCHEMBL5651785 0.93 TSHR (0.52) TSHRCYP2C9MAPK14CYP2D6LMNA
SCHEMBL5651707 0.91 CYP2D6 (0.59) TSHRCYP2C9MAPK14CYP2D6LMNA
SCHEMBL5651158 0.90 TSHR (0.53) TSHRCYP2C9MAPK14CYP2D6USP2
SCHEMBL5652999 0.90 TSHR (0.56) TSHRCYP2C9MAPK14CYP2D6LMNA
SCHEMBL5653282 0.88 TSHR (0.51) TSHRCYP2C9MAPK14CYP2D6LMNA
SCHEMBL5652335 0.87 TSHR (0.55) TSHRCYP2C9MAPK14CYP2D6LMNA
SCHEMBL5653312 0.83 FLT3 (0.46) HSD17B10KDM4E
SCHEMBL5652221 0.83 TNKS2 (0.49) TSHRCYP2C9MAPK14CYP2D6LMNA
SCHEMBL5652228 0.83 TNKS2 (0.49) TSHRCYP2C9MAPK14CYP2D6LMNA

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 161/4885CYP2C9 3314/4885MAPK14 1445/4885

“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.