SCHEMBL5652335

SCHEMBL5652335

Cc1c(Br)cc2[nH]c(-c3ccc(C(=O)NCCCN4CCOCC4)cc3Br)nc2c1C

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.55
CYP2C9 P11712 2/20 0.49
CYP2D6 P10635 1/20 0.49
MAPK14 Q16539 1/20 0.47
LMNA P02545 1/20 0.46
POLB P06746 1/20 0.46
KMT2A Q03164 4/20 0.46
MEN1 O00255 2/20 0.46
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL5650178 0.94 TSHR (0.54) TSHRCYP2C9CYP2D6MAPK14LMNA
SCHEMBL5651790 0.93 TSHR (0.52) TSHRCYP2C9CYP2D6MAPK14LMNA
SCHEMBL5651713 0.91 CYP2D6 (0.59) TSHRCYP2C9CYP2D6MAPK14LMNA
SCHEMBL5651162 0.90 TSHR (0.51) TSHRCYP2C9CYP2D6MAPK14KMT2A
SCHEMBL5653003 0.90 TSHR (0.56) TSHRCYP2C9CYP2D6MAPK14LMNA
SCHEMBL5653276 0.88 TSHR (0.51) TSHRCYP2C9CYP2D6MAPK14LMNA
SCHEMBL5652326 0.87 TSHR (0.55) TSHRCYP2C9CYP2D6MAPK14LMNA
SCHEMBL5653317 0.83 FLT3 (0.46) KDM4E
SCHEMBL5652221 0.83 TNKS2 (0.49) TSHRCYP2C9CYP2D6MAPK14LMNA
SCHEMBL5652228 0.83 TNKS2 (0.49) TSHRCYP2C9CYP2D6MAPK14LMNA

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 3314/4885CYP2D6 3252/4885

“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.