SCHEMBL7499304

SCHEMBL7499304

CCN(C(=O)OC(C)(C)C)[C@H]1CCN(Cc2ccccc2)C1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CCR5 P51681 3/20 0.53
OPRM1 P35372 3/20 0.53
BCHE P06276 3/20 0.52
HSD11B1 P28845 1/20 0.52
ACHE P22303 2/20 0.50
SIGMAR1 Q99720 1/20 0.50
KDM4E B2RXH2 1/20 0.49
CHRM2 P08172 2/20 0.48
CHRM3 P20309 2/20 0.48
CHRM4 P08173 2/20 0.46

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
SCHEMBL34474746 1.00 CCR5 (0.53) CCR5OPRM1BCHEHSD11B1ACHE
SCHEMBL12347237 0.92 OPRM1 (0.51) CCR5OPRM1BCHEHSD11B1ACHE
SCHEMBL8567376 0.90 CCR5 (0.52) CCR5OPRM1BCHEHSD11B1ACHE
SCHEMBL8578092 0.89 HSD11B1 (0.48) CCR5OPRM1BCHEHSD11B1ACHE
SCHEMBL34473195 0.89 HSD11B1 (0.48) CCR5OPRM1BCHEHSD11B1ACHE
SCHEMBL8574081 0.89 HSD11B1 (0.51) CCR5OPRM1BCHEHSD11B1SIGMAR1
SCHEMBL34473196 0.89 HSD11B1 (0.48) CCR5OPRM1BCHEHSD11B1ACHE
SCHEMBL31210944 0.88 HSD11B1 (0.48) CCR5OPRM1BCHEHSD11B1ACHE
SCHEMBL12355143 0.87 HSD11B1 (0.47) CCR5OPRM1BCHEHSD11B1ACHE
SCHEMBL7507555 0.87 SIGMAR1 (0.51) OPRM1BCHEACHESIGMAR1CHRM4

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2026085629-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS, COMPOSITIONS COMPRISING THEM AND USES THEREOF Université de Montréal (CA) 2026-04-30 WO disclosed
US-20110201599-A1 CDK Modulators EXELIXIS, INC. (US) 2011-08-18 US disclosed
EP-0723545-B1 QUINOLIZINONE TYPE COMPOUNDS ABBOTT LAB (US) 2002-05-08 EP disclosed
US-5726182-A TREATMENT OF BACTERIAL INFECTIONS ABBOTT LABORATORIES (US) 1998-03-10 US disclosed
US-5599816-A BACTERICIDE ABBOTT LABORATORIES (US) 1997-02-04 US disclosed
WO-1996039407-A1 QUINOLIZINONE TYPE COMPOUNDS ABBOTT LABORATORIES (US) 1996-12-12 WO disclosed
US-5580872-A ADMINISTERING IN THE TREATMENT OF BACTERIAL INFECTIONS ABBOTT LABORATORIES (US) 1996-12-03 US disclosed
WO-1995010519-A1 QUINOLIZINONE TYPE COMPOUNDS ABBOTT LABORATORIES (US) 1995-04-20 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-20110201599-A1 CDK Modulators CDK3, CDK1, CDKL1 CCR5 4158/4885OPRM1 3693/4885BCHE 2783/4885

“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.