SCHEMBL11549248

SCHEMBL11549248

COc1cccc(-c2nc3ccc(C(=O)O)cc3c(=O)[nH]2)c1OC

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GUSB P08236 5/20 0.56
▸ FGFR1 P11362 2/20 0.48
▸ FGFR2 P21802 2/20 0.48
▸ HDAC6 Q9UBN7 1/20 0.47
▸ POLB P06746 2/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ CYP1A1 P04798 2/20 0.44
▸ CYP1B1 Q16678 2/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ TP53 P04637 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ F2 P00734 1/20 0.43
▸ F10 P00742 1/20 0.43

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
SCHEMBL11549471 0.91 GUSB (0.53) GUSBHDAC6POLBMEN1TSHR
SCHEMBL11554463 0.91 GUSB (0.51) GUSBFGFR1FGFR2HDAC6POLB
SCHEMBL11554055 0.91 GUSB (0.55) GUSBPOLBTSHRNPC1TP53
SCHEMBL11382413 0.90 GUSB (0.59) GUSBHDAC6POLBMEN1TSHR
SCHEMBL11549992 0.89 POLB (0.48) GUSBPOLBMEN1KMT2ANPC1
SCHEMBL11551096 0.88 GUSB (0.48) GUSBHDAC6POLBMEN1KMT2A
SCHEMBL11554449 0.86 GUSB (0.47) GUSBHDAC6POLBMEN1KMT2A
SCHEMBL11379676 0.86 GUSB (0.51) GUSBPOLBMEN1TSHRKMT2A
SCHEMBL11553024 0.84 GUSB (0.57) GUSBPOLBMEN1TSHRKMT2A
SCHEMBL11553336 0.83 GUSB (0.51) GUSBHDAC6POLBMEN1TSHR

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