SCHEMBL31258384

SCHEMBL31258384

O=C(C1CNCC(c2ccccc2)C1)N(Cc1ccc(C2=CCCCC2)cc1)C1CC1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR88 Q9GZN0 3/20 0.43
OPRM1 P35372 2/20 0.39
PAX8 Q06710 2/20 0.37
GCGR P47871 1/20 0.37
GIPR P48546 1/20 0.37
REN P00797 4/20 0.36
BCL9 O00512 2/20 0.36
CTNNB1 P35222 2/20 0.36
CCR5 P51681 1/20 0.35
KCNH2 Q12809 1/20 0.35
CTSD P07339 1/20 0.35
JAK3 P52333 1/20 0.35
HDAC1 Q13547 1/20 0.34
HDAC2 Q92769 1/20 0.34

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
SCHEMBL31258391 0.81 BCL9 (0.47) BCL9CTNNB1
SCHEMBL24872842 0.72 BCL9 (0.70) BCL9CTNNB1
SCHEMBL31258411 0.69 REN (0.51) OPRM1RENBCL9CTNNB1KCNH2
SCHEMBL31258378 0.68 MEN1 (0.43) OPRM1RENBCL9CTNNB1CTSD
SCHEMBL31258376 0.67 CTNNB1 (0.51) BCL9CTNNB1
SCHEMBL31258399 0.66 MC4R (0.51) JAK3HDAC1
SCHEMBL4008398 0.66 AKR1C3 (0.61) JAK3HDAC2
SCHEMBL26302856 0.66 AKR1C3 (0.61) JAK3HDAC2
SCHEMBL4198203 0.64 OPRM1 (0.62) OPRM1CCR5KCNH2CTSD
SCHEMBL3370759 0.64 AGER (0.55) OPRM1CTSD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240391896-A1 SMALL MOLECULE COMPOUND TARGETING BCL9/BETA-CATENIN INTERACTION Nantong Jutai Biotech Co., Ltd. (CN) 2024-11-28 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-20240391896-A1 SMALL MOLECULE COMPOUND TARGETING BCL9/BETA-CATENIN INTERACTION BCL9, BCL9L, BCL2L11 GPR88 2160/4885OPRM1 4604/4885PAX8 2095/4885

“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.