SCHEMBL5652463

SCHEMBL5652463

CCOc1cc(C(=O)NCCCN(CC)CC)ccc1-c1nc2cc(C)c(Cl)cc2[nH]1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.45
TP53 P04637 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HPSE Q9Y251 1/20 0.44
PRSS12 P56730 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
PRMT5 O14744 1/20 0.41
WDR77 Q9BQA1 1/20 0.41
GAA P10253 2/20 0.41
KMT2A Q03164 3/20 0.40
ALDH1A1 P00352 2/20 0.40
RECQL P46063 1/20 0.40
USP7 Q93009 2/20 0.40
KDM4E B2RXH2 1/20 0.40
GLA P06280 1/20 0.40
HSD17B10 Q99714 1/20 0.40
ATP6V1B1 P15313 1/20 0.40
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
MEN1 O00255 2/20 0.39

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
SCHEMBL5652453 0.97 HTT (0.45) HTTTP53SMN1; SMN2HPSEPRSS12
SCHEMBL5649708 0.94 PRSS12 (0.47) HTTTP53SMN1; SMN2PRSS12HDAC6
SCHEMBL5650229 0.93 PRMT5 (0.48) HTTTP53SMN1; SMN2PRSS12HDAC6
SCHEMBL5652330 0.91 TP53 (0.42) HTTTP53SMN1; SMN2PRSS12HDAC6
SCHEMBL5651662 0.90 HTT (0.49) HTTTP53SMN1; SMN2PRSS12HDAC6
SCHEMBL5652313 0.89 TP53 (0.42) HTTTP53SMN1; SMN2PRSS12HDAC6
SCHEMBL5650220 0.89 PRMT5 (0.48) HTTTP53SMN1; SMN2PRSS12HDAC6
SCHEMBL5652238 0.89 FLT3 (0.47) HPSEPRSS12
SCHEMBL5653269 0.87 TP53 (0.47) HTTTP53SMN1; SMN2PRSS12HDAC6
SCHEMBL5653304 0.87 HDAC6 (0.47) HTTTP53SMN1; SMN2HPSEHDAC6

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 HTT 4354/4885TP53 4051/4885SMN1; SMN2 1510/4885

“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.