SCHEMBL28049446

SCHEMBL28049446

CCCC(=O)c1cccc2c1Sc1ccccc1O2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.38
ALDH1A1 P00352 5/20 0.36
HPGD P15428 4/20 0.36
KDM4E B2RXH2 4/20 0.36
MAPT P10636 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
TSHR P16473 4/20 0.35
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
NPSR1 Q6W5P4 4/20 0.35
TDP1 Q9NUW8 3/20 0.35
ALOX15 P16050 2/20 0.35
HSD17B10 Q99714 2/20 0.35
GMNN O75496 2/20 0.35
POLB P06746 2/20 0.35
MAPK1 P28482 2/20 0.35
BLM P54132 2/20 0.35
PMP22 Q01453 2/20 0.35
CMKLR1 Q99788 2/20 0.35

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
SCHEMBL27924285 0.82 ALOX5 (0.38) ALDH1A1KDM4EMEN1KMT2ANPSR1
SCHEMBL7790465 0.81 ALOX5 (0.36) ALDH1A1KDM4EMEN1KMT2ANPSR1
SCHEMBL9496241 0.80 TSHR (0.53) ALDH1A1HPGDKDM4EMAPTSMN1; SMN2
SCHEMBL6450659 0.79 TRPA1 (0.42) LMNAALDH1A1HPGDKDM4EMAPT
SCHEMBL28019646 0.77 P2RX4 (0.35) ALDH1A1HPGDKDM4ESMN1; SMN2L3MBTL1
SCHEMBL9495694 0.77 ALOX5 (0.51) LMNAALDH1A1KDM4EMAPTTSHR
SCHEMBL30445395 0.77 BCHE (0.42) ALDH1A1HPGDMAPTMEN1KMT2A
SCHEMBL706922 0.77 ALOX5 (0.38) LMNAALDH1A1KDM4EMAPTMEN1
SCHEMBL11825239 0.77 ALOX5 (0.38) ALDH1A1KDM4EMEN1KMT2ANPSR1
SCHEMBL1627755 0.74 MAOA (0.44) ALDH1A1NPSR1GABRA1GABRB2

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
CN-105384911-A Reactive epoxy carboxylate compound, resin composition containing the compound and hardener of resin composition NIPPON KAYAKU KK 2016-03-09 CN disclosed