SCHEMBL7614901

SCHEMBL7614901

CCOn1c(=O)cc[nH]c1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.39
LMNA P02545 1/20 0.39
ALDH1A1 P00352 5/20 0.38
TSHR P16473 1/20 0.38
KDM4E B2RXH2 3/20 0.36
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
BRD4 O60885 1/20 0.35
TAF1 P21675 1/20 0.35
BRPF1 P55201 1/20 0.35
CREBBP Q92793 1/20 0.35
CECR2 Q9BXF3 1/20 0.35
BRD9 Q9H8M2 1/20 0.35
TP53 P04637 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HPGD P15428 1/20 0.31
MAPK8 P45983 1/20 0.31
MAPK9 P45984 1/20 0.31
MAPK10 P53779 1/20 0.31
GPR84 Q9NQS5 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
SCHEMBL7743213 0.74 BRD4 (0.31) BRD4TAF1BRPF1CREBBPCECR2
SCHEMBL1913656 0.74
SCHEMBL8952367 0.72 ADRA1D (0.33) ALDH1A1KMT2AMEN1GPR84
SCHEMBL1923337 0.71 CYP1A2 (0.44) LMNAALDH1A1TSHRKDM4EKMT2A
SCHEMBL27469859 0.69
SCHEMBL2586022 0.69
SCHEMBL8195724 0.69 MAPK8 (0.35) TSHRKDM4EBRD4MAPK8
SCHEMBL9118472 0.68 KDM4E (0.39) ALDH1A1KDM4ESMN1; SMN2HPGD
SCHEMBL28561589 0.68 BRD4 (0.35) KMT2AMEN1BRD4TAF1BRPF1
SCHEMBL40761 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108641092-A The preparation method of supermolecule polymer composite micelle based on hydrogen bond 辽宁大学 2018-10-12 CN disclosed
EP-1254219-A2 NUCLEIC ACIDS, PROTEINS, AND ANTIBODIES Human Genome Sciences, Inc. (US) 2002-11-06 EP disclosed
WO-2001055300-A2 NUCLEIC ACIDS, PROTEINS, AND ANTIBODIES HUMAN GENOME SCIENCES, INC. (US) 2001-08-02 WO disclosed