SCHEMBL26352017

SCHEMBL26352017

CC(C)c1ccnc(-c2cnn(CCO)c2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 2/20 0.55
MET P08581 8/20 0.46
TGFBR1 P36897 1/20 0.45
PDE4C Q08493 1/20 0.45
PDE4D Q08499 1/20 0.45
PDE3B Q13370 1/20 0.45
PDE3A Q14432 1/20 0.45
JAK2 O60674 1/20 0.43
JAK1 P23458 1/20 0.43
TYK2 P29597 1/20 0.43
JAK3 P52333 1/20 0.43
HSP90AA1 P07900 1/20 0.42
FEN1 P39748 1/20 0.42
KDM5B Q9UGL1 1/20 0.42
PDK2 Q15119 2/20 0.41
KIT P10721 1/20 0.41
PIK3CA P42336 1/20 0.40
FGFR1 P11362 1/20 0.39
FGFR2 P21802 1/20 0.39
FGFR4 P22455 1/20 0.39

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
SCHEMBL13467139 0.80 PIM1 (0.50) PIM1TGFBR1FGFR3KDR
SCHEMBL26354200 0.80 PIM1 (0.56) PIM1METPDE4CPDE4DPDE3B
SCHEMBL29539635 0.80 PDK2 (0.48) PIM1METTGFBR1FEN1PDK2
SCHEMBL24316435 0.80 PDK2 (0.48) PIM1METTGFBR1FEN1PDK2
SCHEMBL25946710 0.79 PDK2 (0.41) PIM1METPDE4CPDE4DPDE3B
SCHEMBL26352009 0.75 TGFBR1 (0.50) METTGFBR1FEN1PDK2
SCHEMBL10141510 0.75 KDM5B (0.41) METPDE4CPDE4DPDE3BPDE3A
SCHEMBL15341909 0.74 PIM1 (0.47) PIM1TGFBR1KDM5BPDK2KIT
SCHEMBL14688344 0.72 PIM1 (1.00) PIM1
SCHEMBL21193495 0.71 FYN (0.42) PIM1FEN1PDK2FGFR3

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-20230303562-A1 PYRAZOLE COMPOUND AND PREPARATION METHOD THEREFOR AND USE THEREOF SICHUAN KELUN-BIOTECH BIOPHARMACEUTICAL CO., LTD. (CN) 2023-09-28 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-20230303562-A1 PYRAZOLE COMPOUND AND PREPARATION METHOD THEREFOR AND USE THEREOF CYP51A1, CYP4F11, WEE1 PIM1 237/4885MET 1878/4885TGFBR1 1681/4885

“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.