SCHEMBL28040936

SCHEMBL28040936

CC(Oc1ccccc1)S(N)(=O)=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.48
CA2 P00918 4/20 0.48
CA9 Q16790 4/20 0.48
SOS1 Q07889 1/20 0.42
CYP1A2 P05177 2/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
POLB P06746 1/20 0.41
HPGD P15428 2/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
CRHBP P24387 1/20 0.40
CRHR2 Q13324 1/20 0.40
MTNR1A P48039 1/20 0.40
MTNR1B P49286 1/20 0.40
GAA P10253 1/20 0.39
PKM P14618 1/20 0.39
STS P08842 2/20 0.39
KMT2A Q03164 2/20 0.38
MEN1 O00255 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
SCHEMBL7959053 0.79 CYP1A2 (0.41) CA1CA2CA9CYP1A2CYP2C9
SCHEMBL4639247 0.79 MTNR1A (0.43) CA1CA2CA9CYP1A2CYP2C9
SCHEMBL5872309 0.75 CYP1A2 (0.38) CA1CA2CA9CYP1A2CYP2C9
SCHEMBL8552400 0.75 CYP1A2 (0.38) CA1CA2CA9CYP1A2CYP2C9
SCHEMBL4905925 0.75 CA1 (0.44) CA1CA2CA9SOS1ALDH1A1
SCHEMBL8719440 0.73 CA1 (0.47) CA1CA2CA9SOS1CA12
SCHEMBL27256662 0.73 TSHR (0.52) CA1CA2CA9CYP1A2POLB
SCHEMBL3038523 0.72 KMT2A (0.49) CA1CA2CA9CYP1A2CYP2C9
SCHEMBL7107586 0.72 HCAR2 (0.39) CA1CA2CA9POLBHPGD
SCHEMBL6238673 0.72 MTNR1A (0.45) CYP1A2CYP2C9CYP2C19HPGDALDH1A1

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
CN-106435219-B A method of extracting lithium from salt lake brine with high magnesium-lithium ratio 金昆仑锂业有限公司 2019-05-03 CN disclosed
CN-106435219-A Method for extracting lithium from salt lake brine with high magnesium-lithium ratio 青海柴达木兴华锂盐有限公司 2017-02-22 CN disclosed
CN-103476746-B New cortex dopaminergic-and the receptor-mediated Glutamatergic modulators of neurotransmission of NMDA- NEUROSEARCH A/S (SE) 2015-10-14 CN disclosed