SCHEMBL9315856

SCHEMBL9315856

O=C(F)c1ccc(Sc2ccc(-c3ccccc3)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.53
ALDH1A1 P00352 3/20 0.53
SMN1; SMN2 Q16637 4/20 0.48
MAPT P10636 4/20 0.48
RAB9A P51151 3/20 0.46
NPC1 O15118 1/20 0.46
CTDSP1 Q9GZU7 1/20 0.46
L3MBTL1 Q9Y468 3/20 0.45
LMNA P02545 3/20 0.45
PTPN1 P18031 1/20 0.44
GSK3B P49841 1/20 0.44
CDC25B P30305 1/20 0.43
ATM Q13315 1/20 0.43
FFAR1 O14842 1/20 0.43
CYP1A2 P05177 1/20 0.43
HIF1A Q16665 1/20 0.43
ERCC5 P28715 1/20 0.42
FEN1 P39748 1/20 0.42
HAO1 Q9UJM8 1/20 0.42
EGFR P00533 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
SCHEMBL9315786 0.90 HPGD (0.64) HPGDALDH1A1MAPTL3MBTL1LMNA
SCHEMBL11030265 0.88 SMN1; SMN2 (0.60) HPGDALDH1A1SMN1; SMN2MAPTRAB9A
SCHEMBL12757114 0.84 RAB9A (0.59) HPGDALDH1A1SMN1; SMN2MAPTRAB9A
SCHEMBL12757113 0.82 RAB9A (0.62) HPGDALDH1A1SMN1; SMN2MAPTRAB9A
SCHEMBL3282322 0.80 RAB9A (0.64) HPGDALDH1A1SMN1; SMN2MAPTRAB9A
SCHEMBL12212918 0.78 BCL2L1 (0.50) SMN1; SMN2MAPTRAB9ANPC1CTDSP1
SCHEMBL8516000 0.78 ALDH1A1 (0.56) HPGDALDH1A1MAPTLMNACYP1A2
SCHEMBL27902166 0.78 ALDH1A1 (0.56) HPGDALDH1A1MAPTLMNACYP1A2
SCHEMBL21603033 0.78 ALDH1A1 (0.56) HPGDALDH1A1MAPTLMNACYP1A2
SCHEMBL28209874 0.78 ALDH1A1 (0.56) HPGDALDH1A1MAPTLMNACYP1A2

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-5326849-A Method for producing an aromatic poly (thio) ether ketone MITSUBISHI KASEI CORPORATION (JP) 1994-07-05 US disclosed