SCHEMBL11255918

SCHEMBL11255918

O=C(O)CCCCCCCCN1C(=O)NCC1c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.51
ATM Q13315 1/20 0.47
ALDH1A1 P00352 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
PABPC1 P11940 1/20 0.44
TSHR P16473 1/20 0.44
CYP2C19 P33261 1/20 0.44
EIF4H Q15056 1/20 0.44
PTGER4 P35408 6/20 0.44
PTGER2 P43116 2/20 0.44
PTGER3 P43115 3/20 0.43
FABP4 P15090 1/20 0.42
FABP5 Q01469 1/20 0.42
PTGS1 P23219 4/20 0.42
PTGS2 P35354 4/20 0.42
PTGER1 P34995 1/20 0.41
MAPT P10636 1/20 0.41
RXFP1 Q9HBX9 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
SCHEMBL11258889 1.00 GAA (0.51) GAAATMALDH1A1CYP1A2CYP2D6
SCHEMBL11255623 1.00 GAA (0.51) GAAATMALDH1A1CYP1A2CYP2D6
SCHEMBL11267080 1.00 GAA (0.51) GAAATMALDH1A1CYP1A2CYP2D6
SCHEMBL11125775 0.99 GAA (0.50) GAAATMALDH1A1CYP1A2CYP2D6
SCHEMBL11246387 0.88 TSHR (0.45) GAACYP1A2CYP2C9TSHRCYP2C19
SCHEMBL11259085 0.85 MEN1 (0.43) GAAALDH1A1TSHR
SCHEMBL7829770 0.84 ATM (0.48) ATMMAPT
SCHEMBL11268890 0.83 FFAR1 (0.41) GAAPTGER4PTGER2PTGER3FABP4
SCHEMBL7352920 0.83 ATM (0.49) ATM
SCHEMBL9432758 0.82 ITGB3 (0.47) GAA

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-4330550-A ANTICOAGULANTS AND ANALGESICS A. NATTERMANN & CIE. GMBH (DE) 1982-05-18 US claimed