SCHEMBL27617898

SCHEMBL27617898

CC1c2cc(F)ccc2-c2ccccc2N1C=CCS(=O)(=O)c1ccc(O)cc1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.34
STAT3 P40763 1/20 0.32
RORC P51449 1/20 0.32
NSD2 O96028 1/20 0.31
PSEN1 P49768 2/20 0.31
PSEN2 P49810 2/20 0.31
APH1B Q8WW43 2/20 0.31
NCSTN Q92542 2/20 0.31
APH1A Q96BI3 2/20 0.31
PSENEN Q9NZ42 2/20 0.31
KMT2A Q03164 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
SCHEMBL27636779 0.93 PSEN1 (0.32) ESR1STAT3NSD2PSEN1PSEN2
Bicarbonate SCHEMBL27698792 0.91 NSD2 (0.36) NSD2KMT2A
SCHEMBL27636685 0.90 AURKA (0.31) NSD2
SCHEMBL27617731 0.89 RORC (0.32) RORCKMT2A
SCHEMBL27617633 0.89 HSD11B1 (0.32) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL27617668 0.88 GPR3 (0.40) ESR1STAT3PSEN1PSEN2APH1B
SCHEMBL27617653 0.83 AURKA (0.31) NSD2
SCHEMBL27636773 0.83 PSEN1 (0.36) ESR1STAT3RORCPSEN1PSEN2
SCHEMBL27617662 0.82 NSD2 (0.34) NSD2PSEN1PSEN2APH1BNCSTN
SCHEMBL27617590 0.81 GPR3 (0.35) RORCKMT2A

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
CN-1720231-A Substituted dihydrophenanthridinesulfonamides WYETH CORP (US) 2006-01-11 CN claimed
CN-1720231-A Substituted dihydrophenanthridinesulfonamides WYETH CORP (US) 2006-01-11 CN disclosed