SCHEMBL24564652

SCHEMBL24564652

O=C(CSc1ccc(Cl)cc1)N1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.57
SMN1; SMN2 Q16637 3/20 0.57
RAB9A P51151 1/20 0.57
HRH3 Q9Y5N1 10/20 0.56
MEN1 O00255 2/20 0.56
MAPT P10636 2/20 0.56
NPSR1 Q6W5P4 2/20 0.56
ALDH1A1 P00352 1/20 0.56
LMNA P02545 1/20 0.56
TSHR P16473 1/20 0.56
FKBP1A P62942 1/20 0.54
SIGMAR1 Q99720 1/20 0.54
AR P10275 2/20 0.49
HPGD P15428 1/20 0.49
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
HTT P42858 1/20 0.48

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
SCHEMBL24564633 0.92 SIGMAR1 (0.60) SMN1; SMN2RAB9AHRH3ALDH1A1FKBP1A
SCHEMBL24564624 0.90 SIGMAR1 (0.55) KMT2ASMN1; SMN2HRH3MEN1MAPT
SCHEMBL24564589 0.89 RAB9A (0.56) KMT2ASMN1; SMN2RAB9AHRH3MEN1
SCHEMBL24564850 0.89 SIGMAR1 (0.54) KMT2ASMN1; SMN2HRH3MEN1MAPT
SCHEMBL24564585 0.89 SIGMAR1 (0.54) KMT2ASMN1; SMN2HRH3MEN1MAPT
SCHEMBL24564616 0.88 HRH3 (0.58) KMT2ASMN1; SMN2HRH3MEN1MAPT
SCHEMBL24564609 0.87 HRH3 (0.54) KMT2ASMN1; SMN2HRH3MEN1MAPT
SCHEMBL24564691 0.86 ALDH1A1 (0.61) SMN1; SMN2RAB9AHRH3MAPTALDH1A1
SCHEMBL24564726 0.85 SIGMAR1 (0.50) KMT2ASMN1; SMN2RAB9AHRH3MEN1
SCHEMBL24564845 0.85 SMN1; SMN2 (0.52) KMT2ASMN1; SMN2HRH3MEN1MAPT

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-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
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
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 KMT2A 1995/4885SMN1; SMN2 2172/4885RAB9A 2145/4885
US-20220204471-A1 Compounds and Methods for Treating Autoimmune Disorders by Targeting HLA-DQ2 HLA-DRB1, CD74, HLA-B KMT2A 1995/4885SMN1; SMN2 2172/4885RAB9A 2145/4885

“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.