SCHEMBL9310504

SCHEMBL9310504

C=C(CCCOC)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
HPGD P15428 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
MAOA P21397 4/20 0.41
MAOB P27338 4/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.41
ALDH1A1 P00352 1/20 0.38
CA2 P00918 1/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL9310745 0.88 MAOA (0.44) POLBTDP1HPGDSMN1; SMN2MAOA
SCHEMBL11033855 0.82 KDM4E (0.47) POLBTDP1HPGDSMN1; SMN2MEN1
SCHEMBL7984999 0.81 MAOA (0.52) POLBTDP1MAOAMAOBSLC6A4
SCHEMBL7986401 0.81 MAOA (0.52) POLBTDP1MAOAMAOBSLC6A4
SCHEMBL7217517 0.79 L3MBTL1 (0.54) TDP1MAOAMAOBLMNA
SCHEMBL31093062 0.79 MEN1 (0.44) HPGDMEN1KMT2AMAOAMAOB
SCHEMBL20448 0.78 PTGS2 (0.57) MAOAMAOBALDH1A1
SCHEMBL5214695 0.77 TDP1 (0.64) POLBTDP1HPGDSMN1; SMN2MEN1
SCHEMBL28442917 0.77 TSHR (0.52) HPGDSMN1; SMN2MEN1KMT2AMAOA
SCHEMBL7990104 0.76 MAOA (0.56) POLBTDP1HPGDSMN1; SMN2MEN1

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
US-5326489-A Sulfonated polymer NIPPON SHOKUBAI CO., LTD. (JP) 1994-07-05 US disclosed
EP-0523300-B1 Electrorheological fluids NIPPON CATALYTIC CHEM IND (JP) 1994-01-19 EP disclosed
EP-0523300-A1 Electrorheological fluids NIPPON SHOKUBAI KAGAKU KOGYO CO. LTD. (JP) 1993-01-20 EP disclosed