SCHEMBL11564652

SCHEMBL11564652

CC(C)Nc1ccc(NC(=O)C2(C)CC2C)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.47
EPHX2 P34913 3/20 0.39
ALDH1A1 P00352 3/20 0.39
ABL1 P00519 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
NPC1 O15118 1/20 0.38
TSHR P16473 2/20 0.38
DHODH Q02127 1/20 0.36
TDP1 Q9NUW8 2/20 0.36
CNR2 P34972 1/20 0.36
LMNA P02545 1/20 0.36
CYP3A4 P08684 1/20 0.36
THRB P10828 1/20 0.36
ALOX15 P16050 1/20 0.36
ALOX12 P18054 1/20 0.36
RECQL P46063 1/20 0.36
ATM Q13315 1/20 0.36
HSD17B10 Q99714 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL11558201 0.88 RXFP1 (0.47) RXFP1EPHX2ALDH1A1ABL1MEN1
SCHEMBL11557820 0.81 RXFP1 (0.42) RXFP1EPHX2ALDH1A1ABL1MEN1
SCHEMBL11562307 0.81 KMT2A (0.39) EPHX2ALDH1A1MEN1KMT2ANPC1
SCHEMBL11433476 0.81 KMT2A (0.46) EPHX2ALDH1A1ABL1MEN1KMT2A
SCHEMBL11435256 0.81 GLA (0.55) ALDH1A1MEN1KMT2ANPC1CNR2
SCHEMBL11426828 0.80 RAB9A (0.44) ALDH1A1ABL1MAPTCA12CA9
SCHEMBL11565473 0.78 CNR2 (0.39) EPHX2ALDH1A1MEN1KMT2ANPC1
SCHEMBL11427972 0.78 EPHX2 (0.52) RXFP1EPHX2ALDH1A1MEN1KMT2A
SCHEMBL11562240 0.77 GLA (0.44) EPHX2ALDH1A1MEN1KMT2ANPC1
SCHEMBL11433258 0.77 TGM2 (0.49) ALDH1A1NAMPTCA12CA9

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-4168153-A Cycloalkanecarboxanilide derivative herbicides SHELL OIL COMPANY (US) 1979-09-18 US disclosed