SCHEMBL7474050

SCHEMBL7474050

CNC1(c2ccccc2)CCN(CCCC2(c3ccc(Cl)c(Cl)c3)CCCN(C(=O)c3ccccc3)C2)CC1

nearest known ligand 0.81

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TACR2 P21452 17/20 0.81
TACR1 P25103 16/20 0.81
TACR3 P29371 9/20 0.81
CYP3A4 P08684 1/20 0.76
CYP2D6 P10635 1/20 0.76
CYP2C9 P11712 1/20 0.76
CYP2C19 P33261 1/20 0.76
CCR5 P51681 2/20 0.66
HRH1 P35367 1/20 0.51

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
SCHEMBL31224200 1.00 TACR2 (0.81) TACR2TACR1TACR3CYP3A4CYP2D6
SCHEMBL24855387 1.00 TACR2 (0.81) TACR2TACR1TACR3CYP3A4CYP2D6
SCHEMBL7378893 0.92 TACR2 (0.74) TACR2TACR1TACR3CYP3A4CYP2D6
SCHEMBL7307760 0.92 TACR2 (0.79) TACR2TACR1TACR3CYP3A4CYP2D6
SCHEMBL31224303 0.92 TACR2 (0.79) TACR2TACR1TACR3CYP3A4CYP2D6
SCHEMBL24855513 0.92 TACR2 (0.79) TACR2TACR1TACR3CYP3A4CYP2D6
SCHEMBL7309714 0.91 TACR2 (0.78) TACR2TACR1TACR3CYP3A4CYP2D6
Hydrochloric Acid SCHEMBL8593237 0.91 TACR2 (0.78) TACR2TACR1TACR3CYP3A4CYP2D6
SCHEMBL7308765 0.91 TACR2 (0.75) TACR2TACR1TACR3CYP3A4CYP2D6
SCHEMBL7309969 0.90 TACR2 (0.74) TACR2TACR1TACR3CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240336565-A1 SOLID FORMS OF OSANETANT ACER THERAPEUTICS INC. 2024-10-10 US disclosed
EP-0915849-A2 PROCESS FOR THE PREPARATION OF 3,3-DISUBSTITUTED PIPERIDINES Smithkline Beecham S.p.A. (IT) 1999-05-19 EP disclosed
WO-1998005640-A2 PROCESS FOR THE PREPARATION OF 3,3-DISUBSTITUTED PIPERIDINES SMITHKLINE BEECHAM S.P.A. (IT) 1998-02-12 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-20240336565-A1 SOLID FORMS OF OSANETANT OAT, OPA1, CPS1 TACR2 1620/4885TACR1 898/4885TACR3 2174/4885

“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.