SCHEMBL29697148

SCHEMBL29697148

Cc1ccc(SCC(=O)N2CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3)CC2)c(Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 11/20 0.50
ALDH1A1 P00352 2/20 0.50
MEN1 O00255 1/20 0.50
LMNA P02545 1/20 0.50
MAPT P10636 1/20 0.50
TSHR P16473 1/20 0.50
KMT2A Q03164 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
AR P10275 2/20 0.49
SIGMAR1 Q99720 3/20 0.48
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
PKM P14618 1/20 0.43

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
SCHEMBL24564742 1.00 HRH3 (0.50) HRH3ALDH1A1MEN1LMNAMAPT
SCHEMBL24564582 0.90 AR (0.54) HRH3ALDH1A1MEN1LMNAMAPT
SCHEMBL29697017 0.88 MEN1 (0.50) HRH3ALDH1A1MEN1LMNAMAPT
SCHEMBL24564645 0.88 MEN1 (0.50) HRH3ALDH1A1MEN1LMNAMAPT
SCHEMBL24564697 0.88 HRH3 (0.50) HRH3ALDH1A1MEN1LMNAMAPT
SCHEMBL29697150 0.88 AR (0.54) HRH3ALDH1A1MEN1LMNAMAPT
SCHEMBL24564747 0.88 AR (0.54) HRH3ALDH1A1MEN1LMNAMAPT
SCHEMBL24564638 0.87 SIGMAR1 (0.54) HRH3ALDH1A1MEN1LMNAMAPT
SCHEMBL24564625 0.86 MEN1 (0.55) HRH3ALDH1A1MEN1LMNAMAPT
SCHEMBL29696974 0.86 MEN1 (0.55) HRH3ALDH1A1MEN1LMNAMAPT

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-11945790-B2 Compounds and methods for treating autoimmune disorders by targeting HLA-DQ2 IMMUNOMOLECULAR THERAPEUTICS, INC. (US) 2024-04-02 US disclosed
WO-2022140464-A1 COMPOUNDS AND METHODS FOR TREATING AUTOIMMUNE DISORDERS BY TARGETING HLA-DQ2 IMMUNOMOLECULAR THERAPEUTICS, INC. (US) 2022-06-30 WO disclosed
US-20220204471-A1 Compounds and Methods for Treating Autoimmune Disorders by Targeting HLA-DQ2 IMMUNOMOLECULAR THERAPEUTICS, INC. 2022-06-30 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 (2 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-11945790-B2 Compounds and methods for treating autoimmune disorders by targeting HLA-DQ2 HLA-DRB1, CD74, HLA-B HRH3 393/4885ALDH1A1 3804/4885MEN1 3952/4885
US-20220204471-A1 Compounds and Methods for Treating Autoimmune Disorders by Targeting HLA-DQ2 HLA-DRB1, CD74, HLA-B HRH3 393/4885ALDH1A1 3804/4885MEN1 3952/4885

“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.