SCHEMBL8438739

SCHEMBL8438739

Cc1ccc(S(=O)(=O)NCCc2cc(F)c(SCC(=O)O)c(F)c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
TBXAS1 P24557 1/20 0.50
AKR1C3 P42330 1/20 0.49
MAPT P10636 4/20 0.48
TP53 P04637 2/20 0.48
LMNA P02545 1/20 0.48
TSHR P16473 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
TAAR1 Q96RJ0 1/20 0.46
RAB9A P51151 1/20 0.46
PPARG P37231 1/20 0.45
CYP1A2 P05177 1/20 0.45
POLB P06746 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C19 P33261 1/20 0.45
TDP1 Q9NUW8 1/20 0.45

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
SCHEMBL8438979 0.91 TAAR1 (0.58) ALDH1A1MEN1KMT2ATBXAS1MAPT
SCHEMBL8442601 0.89 TAAR1 (0.52) ALDH1A1MEN1KMT2ATBXAS1AKR1C3
SCHEMBL8439475 0.88 TBXA2R (0.59) MEN1KMT2ATBXAS1AKR1C3
SCHEMBL8437940 0.88 TBXAS1 (0.50) ALDH1A1MEN1KMT2ATBXAS1MAPT
SCHEMBL8441801 0.88 ALDH1A1 (0.55) ALDH1A1MEN1KMT2ATBXAS1AKR1C3
SCHEMBL8441016 0.88 ALDH1A1 (0.59) ALDH1A1MEN1KMT2AAKR1C3MAPT
SCHEMBL8441089 0.85 CA1 (0.53) ALDH1A1MEN1KMT2ATBXAS1MAPT
SCHEMBL8441823 0.81 MCL1 (0.39) ALDH1A1KMT2AMAPTLMNAL3MBTL1
SCHEMBL8441806 0.78 TAAR1 (0.54) ALDH1A1MEN1KMT2ATBXAS1MAPT
SCHEMBL8441966 0.77 ALDH1A1 (0.52) ALDH1A1TBXAS1AKR1C3MAPTTAAR1

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-5955505-A TREATING NERVE DEGENERATIVE DISORDERS NIPPON SUISAN KAISHA, LTD. (JP) 1999-09-21 US disclosed