SCHEMBL8653109

SCHEMBL8653109

Cc1ccc(CC(=O)NC2(C(=O)O)CCC(C(C)(C)C)CC2)c(Cl)c1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SHMT1 P34896 2/20 0.39
SHMT2 P34897 2/20 0.39
P2RX7 Q99572 3/20 0.38
KMT2A Q03164 1/20 0.36
ATM Q13315 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
ANO1 Q5XXA6 2/20 0.35
EPHX2 P34913 1/20 0.35
ACKR3 P25106 2/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
KCNJ6 P48051 1/20 0.34
KCNJ5 P48544 1/20 0.34
KCNJ3 P48549 1/20 0.34
FABP4 P15090 1/20 0.33
FABP5 Q01469 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33

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
SCHEMBL8907367 0.90 SHMT1 (0.48) SHMT1SHMT2P2RX7KMT2ASIGMAR1
SCHEMBL8657143 0.89 P2RX7 (0.37) P2RX7KMT2AATMANO1EPHX2
SCHEMBL8657000 0.89 SHMT1 (0.40) SHMT1SHMT2P2RX7SIGMAR1NPC1
SCHEMBL8907160 0.89 NPC1 (0.40) P2RX7KMT2AATMNPC1RAB9A
SCHEMBL8652492 0.87 FFAR4 (0.40) SHMT1SHMT2P2RX7SIGMAR1ANO1
SCHEMBL6474818 0.86 MEN1 (0.41) SHMT1SHMT2P2RX7KMT2ASIGMAR1
SCHEMBL8650591 0.86 SHMT1 (0.46) SHMT1SHMT2P2RX7KMT2AFABP4
SCHEMBL8654468 0.86 SHMT1 (0.38) SHMT1SHMT2P2RX7SIGMAR1EPHX2
SCHEMBL8654098 0.86 SHMT1 (0.38) SHMT1SHMT2P2RX7SIGMAR1EPHX2
SCHEMBL8652410 0.85 SHMT1 (0.43) SHMT1SHMT2P2RX7KMT2ASIGMAR1

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-5847211-A Substituted 1H-3-Aryl-pyrrolidine-2,4-dione derivatives BAYER AKTIENGESELLSCHAFT (DE) 1998-12-08 US disclosed
US-5622917-A PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-04-22 US disclosed