SCHEMBL24513016

SCHEMBL24513016

CCn1c(C)cc2cc(C(C)C)ccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.43
▸ KMT2A Q03164 3/20 0.43
▸ KDM4E B2RXH2 3/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ GAA P10253 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ HTT P42858 2/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ NSD2 O96028 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ RXFP1 Q9HBX9 1/20 0.39
▸ RORA P35398 1/20 0.37
▸ RORC P51449 1/20 0.37
▸ RORB Q92753 1/20 0.37
▸ LMNA P02545 1/20 0.36
▸ PDE10A Q9Y233 1/20 0.36
▸ TRPA1 O75762 1/20 0.35
▸ PTGS1 P23219 1/20 0.35

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
SCHEMBL22479058 0.83 GRIK1 (0.37) KDM4EALDH1A1NPSR1HSD17B10RORA
SCHEMBL22515646 0.81 RORA (0.36) GAARORARORCRORBLMNA
SCHEMBL9581147 0.78 KMT2A (0.47) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL23866836 0.77 MEN1 (0.44) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL9613205 0.76 GPR35 (0.57) KDM4EALDH1A1HSD17B10
SCHEMBL13881352 0.76 GPR35 (0.43) KMT2AKDM4EALDH1A1SMN1; SMN2MAPT
SCHEMBL21335592 0.75 ALDH1A1 (0.45) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL19506933 0.75 PRMT5 (0.45) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL13084772 0.74 RORC (0.54) MEN1KMT2AKDM4EALDH1A1HTT
SCHEMBL11534871 0.73 KDM4E (0.60) KMT2AKDM4EGAASMN1; SMN2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230133504-A1 METHOD OF TREATING GRAFT-VERSUS-HOST DISEASE REGENTS OF THE UNIVERSITY OF MICHIGAN 2023-05-04 — — US disclosed
US-20220185831-A1 STAT3 PROTEIN DEGRADERS UNIV MICHIGAN REGENTS (US) 2022-06-16 — — 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-20220185831-A1 STAT3 PROTEIN DEGRADERS STAT3, JAK2, STAT5A MEN1 3114/4885KMT2A 215/4885KDM4E 29/4885
US-20230133504-A1 METHOD OF TREATING GRAFT-VERSUS-HOST DISEASE HLA-DRB1, CD74, HLA-C MEN1 4045/4885KMT2A 2977/4885KDM4E 3566/4885

“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.

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