SCHEMBL11290597

SCHEMBL11290597

NC(=O)CCCCCC(C(N)=O)c1ccc(C(=O)O)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 2/20 0.46
CPN1 P15169 1/20 0.42
CPB2 Q96IY4 1/20 0.42
EPHX1 P07099 2/20 0.39
MMP9 P14780 1/20 0.38
MMP8 P22894 1/20 0.38
MMP13 P45452 1/20 0.38
TP53 P04637 1/20 0.38
TSHR P16473 1/20 0.38
ENPEP Q07075 1/20 0.37
GRM6 O15303 1/20 0.37
GRM4 Q14833 1/20 0.37
RARB P10826 1/20 0.35
LMNA P02545 2/20 0.35
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA9 Q16790 2/20 0.35
SRD5A2 P31213 1/20 0.34
PARP15 Q460N3 1/20 0.34

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
SCHEMBL1433992 0.85 EPHX1 (0.54) EPHX1LMNAMAPK1MAPTTDP1
SCHEMBL30368876 0.84 ESR1 (0.40) EPHX1MMP9MMP8MMP13TSHR
SCHEMBL1065526 0.83 EPHX1 (0.56) EPHX1LMNAMAPK1
Terephthalic Acid SCHEMBL27542194 0.81 TSHR (0.57) TP53TSHRLMNACA12CA1
Terephthalic Acid SCHEMBL27926668 0.81 TSHR (0.57) TP53TSHRLMNACA12CA1
Terephthalic Acid SCHEMBL15167315 0.81 TSHR (0.57) TP53TSHRLMNACA12CA1
Terephthalic Acid SCHEMBL27926667 0.81 TSHR (0.57) TP53TSHRLMNACA12CA1
Terephthalic Acid SCHEMBL28399657 0.79 RARB (0.42) ANPEPEPHX1TP53TSHRRARB
Terephthalic Acid SCHEMBL28399658 0.79 RARB (0.42) ANPEPEPHX1TP53TSHRRARB
Terephthalic Acid SCHEMBL15167663 0.79 TSHR (0.60) ANPEPTP53TSHRCA12CA1

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
EP-0045694-A2 Two-sheet diffusion transfer photographic assemblages EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1982-02-10 EP disclosed