SCHEMBL11633973

SCHEMBL11633973

Cc1cc(C)n(CC(C)C)c(=O)c1C(N)=O

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
KDM4E B2RXH2 3/20 0.46
KMT2A Q03164 2/20 0.38
MAPT P10636 2/20 0.38
MEN1 O00255 1/20 0.38
THRB P10828 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.37
DPP4 P27487 4/20 0.37
LMNA P02545 3/20 0.37
HTT P42858 1/20 0.37
TSHR P16473 1/20 0.37
HSD17B10 Q99714 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MKNK2 Q9HBH9 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
HPD P32754 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL11636106 0.86 ALDH1A1 (0.47) ALDH1A1KDM4EKMT2AMAPTMEN1
SCHEMBL11635995 0.78 BCL2L1 (0.37) ALDH1A1KDM4EMAPTSMN1; SMN2LMNA
SCHEMBL11635413 0.75 NPC1 (0.43) ALDH1A1KDM4EKMT2AMAPTMEN1
SCHEMBL11636498 0.73 POLB (0.42) ALDH1A1KDM4EKMT2AMAPTMEN1
SCHEMBL11610725 0.73 ALDH1A1 (0.45) ALDH1A1KDM4EKMT2ALMNATSHR
SCHEMBL11637797 0.71 KDM4E (0.77) ALDH1A1KDM4EKMT2AMAPTMEN1
SCHEMBL2212267 0.71 KDM4E (0.40) ALDH1A1KDM4EKMT2AMAPTSMN1; SMN2
SCHEMBL7883039 0.71 CYP1A2 (0.33) KDM4EKMT2AMAPTMEN1THRB
SCHEMBL30521348 0.70 SMN1; SMN2 (0.35) ALDH1A1KDM4EKMT2AMAPTMEN1
SCHEMBL7888426 0.69 GRIN2D (0.41) KDM4EMAPTLMNANPSR1POLB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4108630-A 1-Alkylpyrid-2-ones ROHM AND HAAS COMPANY (US) 1978-08-22 US disclosed
US-4038065-A 1-ALKYLPYRID-2-ONE ROHM AND HAAS COMPANY (US) 1977-07-26 US disclosed