SCHEMBL5652228

SCHEMBL5652228

Cc1cc2nc(-c3ccc(C(=O)NCCCN4CCOCC4)cc3Br)[nH]c2cc1Cl

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TNKS2 Q9H2K2 1/20 0.49
TSHR P16473 2/20 0.49
MAPK14 Q16539 1/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2D6 P10635 1/20 0.47
MET P08581 1/20 0.46
POLB P06746 1/20 0.46
LMNA P02545 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HTR3A P46098 1/20 0.46
ALDH1A1 P00352 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
SCHEMBL5652221 0.97 TNKS2 (0.49) TNKS2TSHRMAPK14CYP2C9CYP2D6
SCHEMBL5653274 0.94 TSHR (0.52) TSHRCYP2C9CYP2D6METLMNA
SCHEMBL5653782 0.93 TNKS2 (0.51) TNKS2TSHRMAPK14CYP2C9CYP2D6
SCHEMBL5651252 0.91 MET (0.49) TSHRCYP2C9CYP2D6METLMNA
SCHEMBL5652701 0.91 MET (0.51) TNKS2MAPK14CYP2C9CYP2D6MET
SCHEMBL5653779 0.90 TNKS2 (0.51) TNKS2TSHRMAPK14CYP2C9CYP2D6
SCHEMBL5648672 0.89 CYP2D6 (0.59) TNKS2TSHRMAPK14CYP2C9CYP2D6
SCHEMBL5651241 0.89 MET (0.49) TSHRCYP2C9CYP2D6METLMNA
SCHEMBL5651622 0.89 TNKS2 (0.52) TNKS2TSHRMAPK14CYP2C9CYP2D6
SCHEMBL5650726 0.88 TSHR (0.53) TNKS2TSHRMAPK14CYP2C9CYP2D6

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 TNKS2 2981/4885TSHR 161/4885MAPK14 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.