SCHEMBL5653993

SCHEMBL5653993

CCOc1cc(C(=O)NCCCN2CCN(c3cccc(Cl)c3)CC2)ccc1-c1nc2c[nH]cnc-2n1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 6/20 0.55
DRD2 P14416 4/20 0.55
ADRA1A P35348 2/20 0.55
LMNA P02545 2/20 0.53
MAPT P10636 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.50
TP53 P04637 1/20 0.50
USP2 O75604 1/20 0.50
ALDH1A1 P00352 1/20 0.50
DRD4 P21917 2/20 0.49
KCNH2 Q12809 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
MEN1 O00255 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
KMT2A Q03164 1/20 0.48
SLC6A4 P31645 1/20 0.48
TSHR P16473 1/20 0.48
GSK3B P49841 1/20 0.48

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
SCHEMBL5651330 0.94 DRD2 (0.55) DRD3DRD2ADRA1ALMNAMAPT
SCHEMBL5653701 0.90 DRD3 (0.58) DRD3DRD2ADRA1ALMNAMAPT
SCHEMBL5650284 0.90 DRD3 (0.58) DRD3DRD2ADRA1ALMNAMAPT
SCHEMBL5653116 0.89 DRD3 (0.58) DRD3DRD2ADRA1ALMNAMAPT
SCHEMBL5650125 0.86 DRD2 (0.60) DRD3DRD2ADRA1ALMNAMAPT
SCHEMBL5654821 0.85 CYP2D6 (0.56) USP2ALDH1A1L3MBTL1CYP2C9TSHR
SCHEMBL14341053 0.81 DRD2 (0.55) DRD3DRD2ADRA1ALMNAMAPT
SCHEMBL5651513 0.80 DRD2 (0.52) DRD3DRD2ADRA1ALMNATP53
SCHEMBL5650416 0.80 KMT2A (0.44) TP53KMT2A
SCHEMBL5653577 0.77 PRMT5 (0.45) MAPTSMN1; SMN2TP53ALDH1A1KMT2A

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 DRD3 3697/4885DRD2 3803/4885ADRA1A 1462/4885

“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.