SCHEMBL24990239

SCHEMBL24990239

CCCCc1ccc2[nH]c(-c3cccc(F)c3)cc2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 5/20 0.48
PPARG P37231 3/20 0.48
S1PR1 P21453 1/20 0.45
ALDH1A1 P00352 5/20 0.44
HPGD P15428 4/20 0.44
KDM4E B2RXH2 3/20 0.44
LMNA P02545 3/20 0.44
MAPT P10636 2/20 0.44
CTSV O60911 1/20 0.43
CTSL P07711 1/20 0.43
CYP1A1 P04798 2/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
THRB P10828 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
GFER P55789 1/20 0.42
HSD17B10 Q99714 1/20 0.42
MAPK1 P28482 1/20 0.42

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
SCHEMBL24988943 0.81 PPARG (0.58) FFAR1PPARGS1PR1ALDH1A1KDM4E
SCHEMBL24988674 0.79 MPL (0.41) ALDH1A1HPGDKDM4ELMNAMAPT
SCHEMBL3161897 0.78 TAAR1 (0.50)
SCHEMBL3259296 0.77 TAAR1 (0.53)
SCHEMBL28632619 0.74 TAAR1 (0.65)
SCHEMBL3159318 0.74 TAAR1 (0.49)
SCHEMBL24989577 0.74 TLR8 (0.39)
SCHEMBL6059457 0.73 TAAR1 (0.46)
SCHEMBL3168333 0.73 TAAR1 (0.48)
SCHEMBL6117781 0.73 KDM4E (0.71) ALDH1A1HPGDKDM4ELMNAMAPT

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
WO-2023013994-A1 NOVEL INDOLE DERIVATIVE, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF 주식회사 미토이뮨테라퓨틱스 2023-02-09 WO disclosed