SCHEMBL27259482

SCHEMBL27259482

CC(=O)c1cnn(Cc2ccncc2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 8/20 0.51
CYP3A4 P08684 1/20 0.47
CYP2C9 P11712 1/20 0.47
HSD17B10 Q99714 1/20 0.47
LMNA P02545 3/20 0.44
ALDH1A1 P00352 3/20 0.44
HTT P42858 2/20 0.44
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
TSHR P16473 1/20 0.44
KDM4E B2RXH2 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
POLB P06746 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
KLK1 P06870 1/20 0.41
ERCC5 P28715 1/20 0.41
SCD O00767 1/20 0.40
SCD5 Q86SK9 1/20 0.40

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
SCHEMBL553565 0.86 HSD17B10 (0.59) KLKB1CYP3A4CYP2C9HSD17B10LMNA
SCHEMBL19300037 0.86 HSD17B10 (0.51) KLKB1HSD17B10LMNAALDH1A1HTT
SCHEMBL13692389 0.86 L3MBTL1 (0.54) KLKB1HSD17B10LMNAALDH1A1HTT
SCHEMBL27364232 0.84 KLKB1 (0.53) KLKB1HSD17B10LMNAALDH1A1HTT
SCHEMBL17229366 0.84 KLKB1 (0.51) KLKB1HSD17B10LMNAALDH1A1HTT
SCHEMBL27259483 0.84 KLKB1 (0.53) KLKB1ALDH1A1TSHRKDM4EKMT2A
SCHEMBL27286142 0.83 HSD17B10 (0.68) KLKB1HSD17B10LMNAALDH1A1HTT
SCHEMBL752774 0.83 LMNA (0.61) KLKB1HSD17B10LMNAALDH1A1HTT
SCHEMBL27286146 0.82 MAOB (0.47) KLKB1HSD17B10LMNAALDH1A1HTT
SCHEMBL17454410 0.81 L3MBTL1 (0.58) KLKB1HSD17B10LMNAALDH1A1HTT

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
WO-2024026486-A2 CDK2 INHIBITORS AND METHODS OF USING THE SAME CEDILLA THERAPEUTICS, INC. (US) 2024-02-01 WO disclosed
WO-2024026484-A2 CDK2 INHIBITORS AND METHODS OF USING THE SAME CEDILLA THERAPEUTICS, INC. (US) 2024-02-01 WO disclosed
WO-2024026483-A2 CDK2 INHIBITORS AND METHODS OF USING THE SAME CEDILLA THERAPEUTICS, INC. (US) 2024-02-01 WO disclosed
WO-2024026481-A2 CDK2 INHIBITORS AND METHODS OF USING THE SAME CEDILLA THERAPEUTICS, INC. (US) 2024-02-01 WO disclosed
WO-2024026479-A2 CDK2 INHIBITORS AND METHODS OF USING THE SAME CEDILLA THERAPEUTICS, INC. (US) 2024-02-01 WO disclosed