SCHEMBL11554055

SCHEMBL11554055

CCOc1cccc(-c2nc3ccc(C(=O)O)cc3c(=O)[nH]2)c1OC

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GUSB P08236 3/20 0.55
▸ NPC1 O15118 2/20 0.54
▸ RAB9A P51151 2/20 0.54
▸ TP53 P04637 2/20 0.54
▸ POLB P06746 1/20 0.54
▸ MAPT P10636 1/20 0.54
▸ TDP1 Q9NUW8 1/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.54
▸ TTR P02766 1/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ PDE10A Q9Y233 1/20 0.46
▸ F2 P00734 1/20 0.45
▸ F10 P00742 1/20 0.45
▸ PLG P00747 1/20 0.45
▸ PLAU P00749 1/20 0.45
▸ PLAT P00750 1/20 0.45
▸ MDM2 Q00987 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ PDE5A O76074 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.41

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
SCHEMBL11553024 0.94 GUSB (0.57) GUSBNPC1RAB9ATP53POLB
SCHEMBL11549471 0.92 GUSB (0.53) GUSBNPC1RAB9ATP53POLB
SCHEMBL11549248 0.91 GUSB (0.56) GUSBNPC1RAB9ATP53POLB
SCHEMBL11384695 0.89 GUSB (0.71) GUSBNPC1RAB9ATP53POLB
SCHEMBL11554449 0.86 GUSB (0.47) GUSBNPC1RAB9ATP53POLB
SCHEMBL11552219 0.86 GUSB (0.49) GUSBNPC1RAB9ATP53POLB
SCHEMBL11551096 0.85 GUSB (0.48) GUSBNPC1RAB9ATP53POLB
SCHEMBL11556023 0.84 GUSB (0.51) GUSBNPC1RAB9ATP53POLB
SCHEMBL11553336 0.84 GUSB (0.51) GUSBNPC1RAB9ATP53POLB
SCHEMBL11549992 0.84 POLB (0.48) GUSBNPC1RAB9ATP53POLB

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-4159330-A ANTIALLERGENS CARLO ERBA S.P.A. (IT) 1979-06-26 — — US disclosed
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