SCHEMBL5654047

SCHEMBL5654047

Cc1cc(C(=O)NCCCN2CCOCC2)ccc1-c1nc2cccc(O)c2[nH]1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.51
POLB P06746 1/20 0.51
CYP2C9 P11712 2/20 0.49
CYP2D6 P10635 1/20 0.49
SMYD2 Q9NRG4 2/20 0.48
TSHR P16473 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 1/20 0.47
KMT2A Q03164 1/20 0.47
GAA P10253 1/20 0.47
USP2 O75604 1/20 0.46
HTT P42858 1/20 0.46
HSD17B10 Q99714 1/20 0.46

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
SCHEMBL5653349 0.93 MAPK14 (0.53) MAPK14POLBCYP2C9CYP2D6SMYD2
SCHEMBL5652502 0.90 CYP2C9 (0.61) CYP2C9CYP2D6TSHRSMN1; SMN2ALDH1A1
SCHEMBL5649763 0.88 TSHR (0.52) MAPK14CYP2C9CYP2D6TSHRKDM4E
SCHEMBL5654052 0.87 POLB (0.51) MAPK14POLBCYP2C9CYP2D6SMYD2
SCHEMBL5651498 0.86 KDM4E (0.54) MAPK14POLBTSHRSMN1; SMN2KDM4E
SCHEMBL5648399 0.86 MAPK14 (0.51) MAPK14POLBCYP2C9CYP2D6SMYD2
SCHEMBL5653282 0.86 TSHR (0.51) MAPK14POLBCYP2C9CYP2D6SMYD2
SCHEMBL5650938 0.85 CYP2C9 (0.61) MAPK14CYP2C9CYP2D6SMYD2TSHR
SCHEMBL5650167 0.84 TSHR (0.54) MAPK14POLBCYP2C9CYP2D6SMYD2
SCHEMBL5654035 0.84 CYP2D6 (0.53) MAPK14POLBCYP2C9CYP2D6SMYD2

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 MAPK14 1445/4885POLB 2161/4885CYP2C9 3314/4885

“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.