SCHEMBL1679897

SCHEMBL1679897

Cc1cc(-c2c(O)c(C)nn(C)c2=O)on1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CSF1R P07333 5/20 0.36
▸ KDM4E B2RXH2 1/20 0.35
▸ USP2 O75604 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ PRKAG1 P54619 1/20 0.34
▸ PRKAA1 Q13131 1/20 0.34
▸ PRKAB1 Q9Y478 1/20 0.34
▸ EGLN2 Q96KS0 1/20 0.34
▸ CDK8 P49336 1/20 0.33
▸ ACVR1 Q04771 1/20 0.33
▸ HCAR2 Q8TDS4 1/20 0.33
▸ ERCC5 P28715 1/20 0.33
▸ FEN1 P39748 1/20 0.33
▸ KMT2A Q03164 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL1679935 0.80 CSF1R (0.35) CSF1RKDM4EUSP2ALDH1A1TSHR
SCHEMBL469635 0.72 KDM4E (0.39) KDM4EALDH1A1CDK8ACVR1LMNA
SCHEMBL3789703 0.71 MAPK8 (0.38) ALDH1A1CDK8ACVR1KMT2ALMNA
SCHEMBL466412 0.69 MAPT (0.36) ALDH1A1CDK8ACVR1LMNASMN1; SMN2
SCHEMBL1679887 0.69 ERCC1 (0.49) KDM4EUSP2ALDH1A1TSHRCDK8
SCHEMBL6260037 0.69 KDM4E (0.40) CSF1RKDM4EUSP2ALDH1A1TSHR
SCHEMBL10288222 0.68 LMNA (0.33) ALDH1A1CDK8ACVR1LMNASMN1; SMN2
SCHEMBL919364 0.68 MAPT (0.38) ALDH1A1TSHRCDK8ACVR1KMT2A
SCHEMBL15935620 0.68 ESR2 (0.42) ALDH1A1CDK8ACVR1KMT2A
SCHEMBL510530 0.68 MAPK8 (0.36) CSF1RKDM4ECDK8ACVR1KMT2A

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-2011045271-A1 HERBICIDALLY ACTIVE, HETEROCYCLYL-SUBSTITUTED PYRIDAZINONES BAYER CROPSCIENCE AG (DE) 2011-04-21 — — WO disclosed
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