SCHEMBL5652798

SCHEMBL5652798

[CH]1C[CH]N(Cc2ccccc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 5/20 0.47
MC4R P32245 1/20 0.40
DRD4 P21917 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
ACHE P22303 2/20 0.38
BCHE P06276 1/20 0.38
BACE1 P56817 1/20 0.38
CYP3A4 P08684 1/20 0.37
HSD17B10 Q99714 1/20 0.37
CCR3 P51677 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
ATM Q13315 1/20 0.37
F2 P00734 1/20 0.36
PLG P00747 1/20 0.36
ELANE P08246 1/20 0.36
CTSG P08311 1/20 0.36
CMA1 P23946 1/20 0.36
CTRC Q99895 1/20 0.36

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
SCHEMBL2228270 0.86 SIGMAR1 (0.56) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL1514871 0.76 SIGMAR1 (0.50) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL688048 0.74 SIGMAR1 (0.48) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL1936134 0.72 SIGMAR1 (0.50) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL60814 0.71 SIGMAR1 (0.74) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL18304983 0.71 SIGMAR1 (0.43) SIGMAR1MC4RDRD4LMNAPOLB
Ammonia Solution, Strong SCHEMBL28160010 0.71 SIGMAR1 (0.48) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL11564682 0.69 SIGMAR1 (0.63) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL159371 0.68 SIGMAR1 (0.61) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL276364 0.68 SIGMAR1 (0.56) SIGMAR1MC4RDRD4ALDH1A1

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 5 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
US-6514970-B1 Pyrrolidines such as benzo(b)thiophene-2-carboxylic acid ((S)-1-((S)-1-(4-(1-benzyl-piperidin-4-yloxy)-3-chloro-benzyl)-pyrrolidin-3 -ylcarbamoyl)-3- methyl-butyl)-amide SMITHKLINE BEECHAM CORPORATION 2003-02-04 US disclosed
EP-1187813-A1 AZOLYLBENZAMIDES AND ANALOGUES AND THEIR USE FOR TREATING OSTEOPOROSIS SMITHKLINE BEECHAM PLC (GB) 2002-03-20 EP disclosed
WO-2001000587-A1 AZOLYLBENZAMIDES AND ANALOGUES AND THEIR USE FOR TREATING OSTEOPOROSIS SMITHKLINE BEECHAM P.L.C. (GB) 2001-01-04 WO 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 SIGMAR1 290/4885MC4R 993/4885DRD4 4657/4885

“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.