SCHEMBL10875474

SCHEMBL10875474

COc1nc(C)nc(N(C)C(=O)NS(=O)(=O)c2ccccc2OC(F)F)n1

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.38
TSHR P16473 1/20 0.38
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
HCRTR1 O43613 2/20 0.34
HCRTR2 O43614 2/20 0.34
SLC22A12 Q96S37 1/20 0.34
KAT6A Q92794 1/20 0.33
NR1I2 O75469 1/20 0.33
HPGD P15428 1/20 0.32
CASP1 P29466 1/20 0.32
ALDH1A1 P00352 3/20 0.32
POLB P06746 1/20 0.32
PKM P14618 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL8441174 0.94 MEN1 (0.36) MEN1KMT2AHCRTR1HCRTR2SLC22A12
SCHEMBL10694204 0.86 ALPL (0.40) SMN1; SMN2TSHRMEN1KMT2AHCRTR1
SCHEMBL9342205 0.85 GAA (0.39) SMN1; SMN2HCRTR1HCRTR2SLC22A12KAT6A
SCHEMBL15026845 0.84 ALKBH2 (0.38) MEN1KMT2AALDH1A1
SCHEMBL10880969 0.83 TSHR (0.35) SMN1; SMN2TSHRMEN1KMT2AALDH1A1
SCHEMBL10876495 0.83 SMN1; SMN2 (0.47) SMN1; SMN2TSHRMEN1KMT2AHCRTR1
SCHEMBL10751914 0.83 MEN1 (0.38) SMN1; SMN2TSHRMEN1KMT2AALDH1A1
SCHEMBL16169466 0.82 MEN1 (0.36) SMN1; SMN2TSHRMEN1KMT2AALDH1A1
SCHEMBL10475119 0.82 MEN1 (0.39) SMN1; SMN2TSHRMEN1KMT2AALDH1A1
Tribenuron Methyl SCHEMBL30438049 0.81 KMT2A (0.43) MEN1KMT2APOLBTDP1

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-H168-H Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1986-12-02 US claimed
US-H168-H Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1986-12-02 US disclosed