SCHEMBL5653701

SCHEMBL5653701

Cc1cc(C(=O)NCCCN2CCN(c3cccc(Cl)c3)CC2)ccc1-c1nc2c[nH]cnc-2n1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 4/20 0.58
DRD2 P14416 3/20 0.58
ADRA1A P35348 2/20 0.58
MAPT P10636 5/20 0.55
LMNA P02545 3/20 0.55
USP2 O75604 1/20 0.52
ALDH1A1 P00352 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
TP53 P04637 3/20 0.52
KCNH2 Q12809 1/20 0.51
SLC6A4 P31645 3/20 0.51
HTR2A P28223 3/20 0.51
HTR2C P28335 3/20 0.51
TSHR P16473 1/20 0.49
GSK3B P49841 1/20 0.49
DRD4 P21917 1/20 0.49

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
SCHEMBL5653116 0.91 DRD3 (0.58) DRD3DRD2ADRA1AMAPTLMNA
SCHEMBL5650284 0.91 DRD3 (0.58) DRD3DRD2ADRA1AMAPTLMNA
SCHEMBL5651330 0.90 DRD2 (0.55) DRD3DRD2ADRA1AMAPTLMNA
SCHEMBL5653993 0.90 DRD3 (0.55) DRD3DRD2ADRA1AMAPTLMNA
SCHEMBL5650125 0.88 DRD2 (0.60) DRD3DRD2ADRA1AMAPTLMNA
SCHEMBL5650188 0.83 POLB (0.54) USP2ALDH1A1SMN1; SMN2TSHR
SCHEMBL5651513 0.78 DRD2 (0.52) DRD3DRD2ADRA1ALMNATP53
SCHEMBL5652737 0.74 SLC6A2 (0.57) DRD3DRD2ADRA1AMAPTSMN1; SMN2
SCHEMBL5654821 0.74 CYP2D6 (0.56) USP2ALDH1A1TSHR
SCHEMBL7438237 0.74 DRD3 (1.00) DRD3DRD2ADRA1AKCNH2SLC6A4

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.