SCHEMBL21920140

SCHEMBL21920140

C=CCCOP(OCCC=C)Oc1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.35
KCNA3 P22001 1/20 0.34
THRB P10828 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ALDH1A1 P00352 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TAAR1 Q96RJ0 1/20 0.31
RECQL P46063 1/20 0.31
LTA4H P09960 1/20 0.30
TSHR P16473 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
SCHEMBL14216106 0.88 LMNA (0.33) ALDH1A1TSHR
SCHEMBL21920446 0.86 KCNA3 (0.38) KDM4EKCNA3THRBMEN1KMT2A
SCHEMBL548672 0.81 CYP3A4 (0.36) KDM4EKCNA3THRBMEN1KMT2A
SCHEMBL14354354 0.78 KCNA3 (0.44) KCNA3KMT2AALDH1A1TAAR1RECQL
SCHEMBL250539 0.77 CYP3A4 (0.36) KDM4EKCNA3THRBMEN1KMT2A
SCHEMBL1727346 0.75 LTA4H (0.42) KCNA3MEN1KMT2AALDH1A1TAAR1
SCHEMBL11434366 0.75 ALDH1A1 (0.48) KCNA3KMT2AALDH1A1TAAR1RECQL
Allylanisole SCHEMBL4737421 0.74 KCNA3 (0.58) KDM4EKCNA3THRBMEN1KMT2A
SCHEMBL25813074 0.74 KCNA3 (0.46) KCNA3ALDH1A1TAAR1RECQLLTA4H
SCHEMBL733602 0.74 LTA4H (0.42) THRBSMN1; SMN2ALDH1A1LTA4HTSHR

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
EP-3049502-B1 LONG-TERM STABLE PHOTOACTIVE COMPOSITION, SUCH AS PHOSPHORESCENT COMPOSITION OR TTA-PHOTON UPCONVERSION COMPOSITION MAX PLANCK GESELLSCHAFT (DE) 2020-04-01 EP disclosed