SCHEMBL8730072

SCHEMBL8730072

CCCC(=O)Oc1ccc2c(c1)CC(CNC(=O)OCc1ccccc1)C2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.46
MAPT P10636 3/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ACHE P22303 2/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CYP2D6 P10635 3/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
USP2 O75604 2/20 0.40
TP53 P04637 2/20 0.40
CYP3A4 P08684 2/20 0.40
TSHR P16473 2/20 0.40
CYP2C19 P33261 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
HTR7 P34969 2/20 0.40
HTR6 P50406 2/20 0.40
OPRM1 P35372 2/20 0.40
LMNA P02545 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40

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
SCHEMBL8731674 0.80 LMNA (0.54) MAPTACHECYP2D6MEN1KMT2A
SCHEMBL8730081 0.80 TBXA2R (0.45) MAPTL3MBTL1ACHECYP2D6MEN1
SCHEMBL8728445 0.79 TBXA2R (0.57) MEN1KMT2AALDH1A1TBXA2R
SCHEMBL8757978 0.78 TBXA2R (0.49) MAPTACHECYP2D6MEN1KMT2A
SCHEMBL8982166 0.77 CYP3A4 (0.41) MAPTL3MBTL1ACHECYP2D6MEN1
SCHEMBL8728457 0.75 ACACB (0.50) HIF1A
SCHEMBL27266951 0.72 CA1 (0.61) ACHECA1CA2TSHRPSEN1
SCHEMBL27574117 0.72 MAPT (0.58) MAPTMEN1KMT2ATP53LMNA
SCHEMBL27830337 0.72 MGLL (0.60) ATMMAPTTP53CYP3A4TSHR
SCHEMBL14669087 0.72 LMNA (0.52) MAPTACHECYP2D6MEN1KMT2A

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-5750524-A ADMINISTERING AN SULFAMIDE SUBSTITUTED INDAN DERIVATIVE ZERIA PHARMACEUTICAL CO., LTD. (JP) 1998-05-12 US disclosed