SCHEMBL25385142

SCHEMBL25385142

NC(CCCCF)CNc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ FNTA P49354 3/20 0.46
▸ FNTB P49356 3/20 0.46
▸ MAPT P10636 3/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ DNM1 Q05193 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ MMP2 P08253 1/20 0.35
▸ S1PR4 O95977 1/20 0.34
▸ S1PR1 P21453 1/20 0.34
▸ S1PR5 Q9H228 1/20 0.34

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
SCHEMBL23454485 0.81 SPHK1 (0.48) FNTAFNTBMAPTALDH1A1SMN1; SMN2
SCHEMBL26436976 0.81 SPHK1 (0.48) FNTAFNTBMAPTALDH1A1SMN1; SMN2
SCHEMBL3766063 0.77 FNTA (0.50) FNTAFNTBMAPTALDH1A1HTT
SCHEMBL31075564 0.73 FNTA (0.44) FNTAFNTBMAPTALDH1A1HTT
SCHEMBL7498532 0.73 ALDH1A1 (0.73) MAPTALDH1A1L3MBTL1
SCHEMBL25383961 0.72 FNTA (0.46) FNTAFNTBMAPTALDH1A1DNM1
SCHEMBL10847698 0.72 FNTA (0.53) FNTAFNTBMAPTALDH1A1DNM1
SCHEMBL17711572 0.71 ALDH1A1 (0.70) MAPTALDH1A1HTTL3MBTL1
SCHEMBL26205467 0.71 FNTA (0.45) FNTAFNTBMAPTALDH1A1HTT
SCHEMBL6642732 0.71 ALDH1A1 (0.76) MAPTALDH1A1L3MBTL1

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
WO-2023164186-A1 BENZOTHIA(DIA)ZEPINE COMPOUNDS FOR TREATMENT OF HBV AND HDV ASSEMBLY BIOSCIENCES, INC. (US) 2023-08-31 — — WO disclosed
WO-2023164186-A1 BENZOTHIA(DIA)ZEPINE COMPOUNDS FOR TREATMENT OF HBV AND HDV ASSEMBLY BIOSCIENCES, INC. (US) 2023-08-31 — — WO disclosed
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