SCHEMBL24252409

SCHEMBL24252409

O=C1C=C(c2ccncn2)C(O)O1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 1/20 0.33
CCNA2 P20248 1/20 0.33
CDK2 P24941 1/20 0.33
CDK9 P50750 1/20 0.33
CCNA1 P78396 1/20 0.33
CDK5 Q00535 1/20 0.33
CDK5R1 Q15078 1/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
GSK3B P49841 3/20 0.32
CAMKK2 Q96RR4 1/20 0.32
CDC7 O00311 1/20 0.31
ADORA2B P29275 3/20 0.31
ADORA2A P29274 2/20 0.31
ADORA1 P30542 2/20 0.31
SCD O00767 1/20 0.31
SCD5 Q86SK9 1/20 0.31
P2RX7 Q99572 1/20 0.30
ADORA3 P0DMS8 1/20 0.30

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
SCHEMBL24252410 0.82 CCNT1 (0.33) CCNT1CCNA2CDK2CDK9CCNA1
SCHEMBL24252411 0.77 CYP2D6 (0.33) CCNT1CCNA2CDK2CDK9CCNA1
SCHEMBL24252408 0.77 GSK3B (0.33) CCNT1CCNA2CDK2CDK9CCNA1
SCHEMBL24252406 0.74 CYP2D6 (0.37) LMNAGAAGSK3B
SCHEMBL24252414 0.74 GSK3B (0.38) GSK3BCAMKK2CDC7ADORA2BADORA2A
SCHEMBL24252407 0.73 GSK3B (0.40) GSK3BCAMKK2SCDSCD5
SCHEMBL24252413 0.72 GSK3B (0.43) GSK3B
SCHEMBL24252373 0.71 HDAC4 (0.33) P2RX7
SCHEMBL24252372 0.70 ALDH1A1 (0.33)
SCHEMBL2814353 0.65 HSP90AA1 (0.52) CCNT1CCNA2CDK2CDK9CCNA1

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
WO-2022034203-A1 PROCESS FOR THE PREPARATION OF PYRIDAZINONE DERIVATIVES SYNGENTA CROP PROTECTION AG (CH) 2022-02-17 WO disclosed