SCHEMBL8360847

SCHEMBL8360847

O=S(=O)(O)C(c1ccccc1)c1ccc(C(c2ccccc2)S(=O)(=O)O)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 4/20 0.56
ALDH1A1 P00352 2/20 0.54
CYP2C19 P33261 1/20 0.52
TSHR P16473 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
LMNA P02545 3/20 0.42
KDM4E B2RXH2 1/20 0.42
GMNN O75496 1/20 0.42
POLB P06746 1/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42
PMP22 Q01453 1/20 0.42
KMT2A Q03164 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
CYP2D6 P10635 1/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41

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
SCHEMBL496890 0.97 SRC (0.58) SRCALDH1A1CYP2C19TSHRSMN1; SMN2
SCHEMBL9244633 0.95 SRC (0.56) SRCALDH1A1CYP2C19TSHRSMN1; SMN2
SCHEMBL7724506 0.89 LMNA (0.47) SRCALDH1A1CYP2C19SMN1; SMN2LMNA
SCHEMBL1439868 0.85 SLC6A3 (0.54) SRCALDH1A1CYP2C19SMN1; SMN2LMNA
SCHEMBL27601765 0.85 SRC (0.47) SRCALDH1A1CYP2C19TSHRSMN1; SMN2
SCHEMBL29001104 0.84 UGT2B7 (0.47) SRCALDH1A1CYP2C19KMT2ACYP2D6
SCHEMBL27891280 0.84 MAOA (0.44) SRCALDH1A1CYP2C19MAPTTDP1
SCHEMBL8364104 0.82 SRC (0.41) SRCALDH1A1CYP2C19TSHRSMN1; SMN2
SCHEMBL8364114 0.81 SRC (0.47) SRCALDH1A1CYP2C19TSHRSMN1; SMN2
SCHEMBL6328868 0.79 TSHR (0.52) SRCALDH1A1CYP2C19TSHRSMN1; SMN2

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-5817430-A POLYARYLENEVINYLENE POLYMER XEROX CORPORATION (US) 1998-10-06 US claimed
US-5876865-A POLYARYLENEVINYLENE RESIN XEROX CORPORATION (US) 1999-03-02 US disclosed
US-5817430-A POLYARYLENEVINYLENE POLYMER XEROX CORPORATION (US) 1998-10-06 US disclosed