SCHEMBL24950489

SCHEMBL24950489

Cc1cc(C(C)C)c(C(C)C)nn1

nearest known ligand 0.31

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
TDP2 O95551 1/20 0.31
NSD2 O96028 1/20 0.31
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
BLM P54132 1/20 0.31
KMT2A Q03164 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TRPA1 O75762 1/20 0.31
LMNA P02545 1/20 0.31
CHRM1 P11229 1/20 0.31
SLC6A2 P23975 1/20 0.31
ADRA1A P35348 1/20 0.31
HTR2B P41595 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
MAOB P27338 1/20 0.31

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
SCHEMBL12896009 0.78 MAOB (0.31) MAOB
SCHEMBL12896014 0.78 LMNA (0.32) TRPA1LMNACHRM1SLC6A2ADRA1A
SCHEMBL12796017 0.76 CA1 (0.31) CA1CA2
SCHEMBL3966316 0.74 POLB (0.34) KDM4EMEN1TDP2NSD2ALDH1A1
SCHEMBL25928416 0.74 GABRA1 (0.37) TRPA1LMNACHRM1SLC6A2ADRA1A
SCHEMBL25928383 0.74
SCHEMBL25484400 0.74
SCHEMBL16454720 0.74 GABRA1 (0.37) TRPA1LMNACHRM1SLC6A2ADRA1A
SCHEMBL10280848 0.71 POLB (0.35) KDM4EALDH1A1POLBMAPTLMNA
SCHEMBL17813866 0.71 ALDH1A1 (0.35) ALDH1A1POLBLMNA

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-20230023761-A1 SUBSTITUTED PYRIDINES AS TYK2 INHIBITORS ALUMIS INC. 2023-01-26 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-20230023761-A1 SUBSTITUTED PYRIDINES AS TYK2 INHIBITORS TYK2, JAK1, PDXK KDM4E 258/4885MEN1 925/4885TDP2 480/4885

“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.