SCHEMBL4359857

SCHEMBL4359857

O=S(=O)(O)c1cc[c]cc1Cl

nearest known ligand 0.31

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP3A4 P08684 1/20 0.31
THRB P10828 1/20 0.31
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
CASP1 P29466 1/20 0.31
RECQL P46063 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TTR P02766 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL5087497 0.85 ALDH1A1 (0.31) TSHRALDH1A1CYP3A4THRBHPGD
SCHEMBL5663517 0.82 TTR (0.32) TSHRALDH1A1TTRSMN1; SMN2
SCHEMBL6632452 0.78 HSD17B10 (0.33) TSHRALDH1A1HPGDCASP1HSD17B10
SCHEMBL442816 0.78 HSD11B1 (0.33)
SCHEMBL3807203 0.78 CA2 (0.41)
SCHEMBL5417323 0.77 MYC (0.35) RECQL
SCHEMBL588012 0.77 TTR (0.41) TSHRALDH1A1CYP3A4THRBHPGD
SCHEMBL3246115 0.74 HSD17B10 (0.37) TSHRALDH1A1HPGDHSD17B10TTR
SCHEMBL4905351 0.74 MYC (0.36) TSHRALDH1A1CYP3A4THRBHPGD
SCHEMBL5449834 0.74 ALDH1A1 (0.44) TSHRALDH1A1SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7582149-B2 Monoazo colorants from pyrazolobenzodiazinedioxides EASTMAN KODAK COMPANY (US) 2009-09-01 US disclosed
US-20090181170-A1 MONOAZO COLORANTS FROM PYRAZOLOBENZODIAZINEDIOXIDES NPEC INC. 2009-07-16 US disclosed