SCHEMBL7737426

SCHEMBL7737426

COC(=O)CCC(=O)c1ccc(OC)c(-c2ccccc2)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.50
SMN1; SMN2 Q16637 4/20 0.50
MAPT P10636 2/20 0.50
HPGD P15428 2/20 0.50
CTSA P10619 1/20 0.50
THRA P10827 1/20 0.49
THRB P10828 1/20 0.49
CTNNB1 P35222 4/20 0.49
WNT3A P56704 4/20 0.49
ALDH1A1 P00352 2/20 0.45
LMNA P02545 2/20 0.45
SYK P43405 1/20 0.45
AURKB Q96GD4 1/20 0.45
INCENP Q9NQS7 1/20 0.45
LTB4R Q15722 1/20 0.45
MEN1 O00255 2/20 0.44
CYP3A4 P08684 1/20 0.44
GAA P10253 1/20 0.44
TDP1 Q9NUW8 2/20 0.44
MAPK1 P28482 1/20 0.43

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
SCHEMBL7735238 0.89 SMN1; SMN2 (0.55) KMT2ASMN1; SMN2MAPTHPGDCTSA
SCHEMBL14241376 0.83 SMN1; SMN2 (0.60) KMT2ASMN1; SMN2MAPTHPGDCTSA
SCHEMBL17485108 0.82 CTSA (0.50) KMT2ASMN1; SMN2MAPTHPGDCTSA
SCHEMBL11710256 0.80 CTSA (0.49) KMT2ASMN1; SMN2MAPTHPGDCTSA
SCHEMBL35823 0.80 PTGS2 (0.58) KMT2ASMN1; SMN2MAPTCTSAALDH1A1
SCHEMBL10001233 0.79 SMN1; SMN2 (0.66) KMT2ASMN1; SMN2MAPTHPGDALDH1A1
SCHEMBL402416 0.79 CA12 (0.62) KMT2ACTSAALDH1A1LMNASYK
SCHEMBL9524595 0.78 SYK (0.63) KMT2ASMN1; SMN2MAPTCTSAALDH1A1
SCHEMBL7733973 0.78 THRA (0.49) KMT2ASMN1; SMN2MAPTHPGDTHRA
SCHEMBL7735763 0.77 PTPN1 (0.54) KMT2AHPGDLMNALTB4RL3MBTL1

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
US-6376546-B1 ANTIALLERGENS ASAHI KASEI KABUSHIKI KAISHA (JP) 2002-04-23 US disclosed
EP-1024130-A1 BIPHENYL-5-ALKANOIC ACID DERIVATIVES AND USE THEREOF Asahi Kasei Kogyo Kabushiki Kaisha (JP) 2000-08-02 EP disclosed