SCHEMBL11682698

SCHEMBL11682698

Nc1ccccc1C(F)(F)F.O=S(=O)=Nc1cccc(CS(=O)(=O)O)c1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.33
▸ FFAR4 Q5NUL3 2/20 0.33
▸ MRGPRX4 Q96LA9 1/20 0.31
▸ SLC9A1 P19634 1/20 0.31
▸ EPHX2 P34913 1/20 0.31
▸ CNR2 P34972 1/20 0.30
▸ DPP4 P27487 1/20 0.30
▸ DPP8 Q6V1X1 1/20 0.30
▸ PTGS1 P23219 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
SCHEMBL11684116 0.88 FFAR4 (0.32) FFAR4SLC9A1
SCHEMBL11682454 0.83 SENP3 (0.44) FFAR4MRGPRX4SLC9A1
SCHEMBL11680182 0.82 TSHR (0.38) —
Aniline SCHEMBL11683612 0.81 PRMT1 (0.38) LMNA
SCHEMBL11682708 0.77 POLB (0.42) FFAR4
3-Chloroaniline SCHEMBL11684018 0.76 ALDH1A1 (0.44) —
SCHEMBL11683452 0.75 TP53 (0.41) —
SCHEMBL11683650 0.73 FFAR4 (0.34) FFAR4
SCHEMBL11682813 0.73 POLB (0.41) FFAR4
SCHEMBL11681656 0.71 HDAC3 (0.33) FFAR4

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4055557-A MONOAZO DYES BAYER AKTIENGESELLSCHAFT (DT) 1977-10-25 — — US disclosed
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