SCHEMBL5651255

SCHEMBL5651255

O=C(NCCCN1CCOCC1)C1=CC(c2nc3cc(Cl)c(F)cc3[nH]2)=CCC1=S

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 1/20 0.41
POLB P06746 1/20 0.41
MAPK1 P28482 1/20 0.41
DUSP3 P51452 1/20 0.41
PTPN5 P54829 1/20 0.41
PTPN11 Q06124 1/20 0.41
KLK7 P49862 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
EGFR P00533 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
BCL3 P20749 1/20 0.39
RAB9A P51151 1/20 0.39
MET P08581 1/20 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
SCHEMBL5652804 0.91 SMYD2 (0.42) ALDH1A1KDM4EPOLBMAPK1DUSP3
SCHEMBL5648377 0.86 FLT3 (0.39) KDM4E
SCHEMBL5651065 0.84 POLB (0.44) ALDH1A1KDM4EPOLBMAPK1DUSP3
SCHEMBL5648730 0.80 HDAC3 (0.51) ALDH1A1KDM4EPOLBMAPK1DUSP3
SCHEMBL5653202 0.79 MET (0.51) ALDH1A1MEN1KMT2AMET
SCHEMBL5649572 0.79 TSHR (0.51) ALDH1A1POLBMAPK1L3MBTL1MEN1
SCHEMBL5651258 0.78 L3MBTL1 (0.51) ALDH1A1KDM4EMAPK1KLK7L3MBTL1
SCHEMBL5652193 0.77 FLT3 (0.41)
SCHEMBL5651675 0.77 MET (0.51) ALDH1A1POLBL3MBTL1MET
SCHEMBL5651241 0.77 MET (0.49) MEN1KMT2AMET

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 ALDH1A1 2893/4885KDM4E 1605/4885POLB 2161/4885

“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.