SCHEMBL20019616

SCHEMBL20019616

CC(=O)c1ccc(S(=O)(=O)N2CC(=O)NC23CCN(C)CC3)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GFER P55789 1/20 0.54
▸ LMNA P02545 1/20 0.53
▸ ALDH1A1 P00352 4/20 0.48
▸ NPC1 O15118 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ AKR1B1 P15121 2/20 0.44
▸ KMT2A Q03164 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ POLB P06746 2/20 0.40
▸ TDP1 Q9NUW8 2/20 0.40
▸ RXFP1 Q9HBX9 2/20 0.40
▸ USP5 P45974 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ APOBEC3A P31941 1/20 0.39
▸ APOBEC3G Q9HC16 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ USP2 O75604 1/20 0.39
▸ TSHR P16473 1/20 0.39

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
SCHEMBL12622139 0.91 GFER (0.60) GFERLMNAALDH1A1NPC1MAPT
SCHEMBL12624024 0.88 GFER (0.56) GFERLMNAALDH1A1NPC1MAPT
SCHEMBL12626996 0.83 GFER (0.47) GFERALDH1A1NPC1MAPTRAB9A
SCHEMBL12623948 0.74 LMNA (0.57) LMNAALDH1A1NPC1MAPTRAB9A
SCHEMBL12621912 0.72 GFER (0.52) GFERLMNAALDH1A1NPC1MAPT
SCHEMBL12626285 0.71 ALDH1A1 (0.56) GFERLMNAALDH1A1NPC1MAPT
SCHEMBL5560091 0.70 LMNA (1.00) LMNAALDH1A1NPC1MAPTRAB9A
SCHEMBL24106966 0.70 GFER (0.36) GFERALDH1A1MAPTAKR1B1POLB
SCHEMBL12623932 0.68 ALDH1A1 (0.56) GFERLMNAALDH1A1NPC1MAPT
SCHEMBL12626312 0.68 ALDH1A1 (0.57) GFERLMNAALDH1A1NPC1MAPT

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
EP-2918587-B1 Filamin A binding compounds and their use as anti-inflammatory and analgesic agents PAIN THERAPEUTICS INC (US) 2018-04-04 — — EP disclosed
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