SCHEMBL25753038

SCHEMBL25753038

Cc1nn(C)c(C)c1-c1cn[nH]c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 4/20 0.39
HTR7 P34969 2/20 0.38
HTR1A P08908 1/20 0.38
KCNH2 Q12809 1/20 0.38
AKT1 P31749 1/20 0.37
AKT2 P31751 1/20 0.37
PRMT5 O14744 1/20 0.36
WDR77 Q9BQA1 1/20 0.36
LMNA P02545 1/20 0.36
APEX1 P27695 1/20 0.36
PMP22 Q01453 1/20 0.36
PDPK1 O15530 1/20 0.36
CREBBP Q92793 1/20 0.35
PDE10A Q9Y233 3/20 0.35
DHODH Q02127 1/20 0.35
MAPT P10636 1/20 0.35
POLB P06746 1/20 0.35
PDE2A O00408 2/20 0.33
CDC7 O00311 1/20 0.33
CCNE1 P24864 1/20 0.33

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
SCHEMBL24088572 0.82 KCNH2 (0.38) KCNH2AKT1AKT2LMNAAPEX1
SCHEMBL16200323 0.72 ALDH1A1 (0.39) KCNH2AKT1AKT2LMNAAPEX1
SCHEMBL14062350 0.72 BRD4 (0.44) BRD4HTR7HTR1APRMT5WDR77
SCHEMBL30301433 0.71 ROCK2 (0.32) ADORA2AADORA2BADORA1
SCHEMBL21241065 0.71 PIM1 (0.42) KCNH2AKT1AKT2LMNAAPEX1
SCHEMBL1423367 0.71 PRMT5 (0.45) BRD4HTR7HTR1APRMT5WDR77
SCHEMBL20320421 0.69 MAPT (0.67) BRD4HTR7HTR1AAKT2LMNA
SCHEMBL12944870 0.69 MAPT (0.47) BRD4HTR7HTR1APRMT5WDR77
SCHEMBL21233196 0.69 CYP11B2 (0.47) BRD4KCNH2AKT1AKT2PRMT5
SCHEMBL4566614 0.69 PDPK1 (0.44) BRD4HTR7HTR1APRMT5WDR77

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-11685731-B2 Processes of preparing a JAK1 inhibitor INCYTE CORPORATION (US) 2023-06-27 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-11685731-B2 Processes of preparing a JAK1 inhibitor JAK1, JAK2, JAK3 BRD4 445/4885HTR7 2828/4885HTR1A 1428/4885

“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.