SCHEMBL7997474

SCHEMBL7997474

CC1=C[C]C=C(C(=O)O)C1=O

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTH P32929 1/20 0.38
TPMT P51580 1/20 0.33
KDM4E B2RXH2 2/20 0.31
KMT2A Q03164 1/20 0.31
GAA P10253 1/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.31
NOTUM Q6P988 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
SCHEMBL7997479 0.65 CTH (0.35) CTH
SCHEMBL8056179 0.62 KDM4E (0.33) CTHKDM4EKMT2AHPGDHSD17B10
SCHEMBL27697249 0.56 CTH (0.35) CTH
SCHEMBL27288275 0.56 POLB (0.31)
SCHEMBL16387368 0.56
SCHEMBL22453898 0.55 HAAO (0.32) CTHTPMT
SCHEMBL27723749 0.54 TSHR (0.41) KDM4EGAA
SCHEMBL10964095 0.54 ALOX15 (0.36) CTHKDM4EKMT2AHPGDHSD17B10
SCHEMBL5052149 0.53 TPMT (0.56) TPMTKDM4EHPGDHSD17B10NOTUM
SCHEMBL235710 0.52 KDM4E (0.54) TPMTKDM4EKMT2AGAAHPGD

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
EP-0998946-A1 Non-porphyrin compound for use as a diagnosticum and/or pharmaceutical K.U. LEUVEN RESEARCH & DEVELOPMENT (BE) 2000-05-10 EP claimed
WO-2000009169-A1 NON-PORPHYRIN COMPOUND FOR USE AS A DIAGNOSTICUM AND/OR PHARMACEUTICAL K.U. LEUVEN RESEARCH & DEVELOPMENT (BE) 2000-02-24 WO claimed