SCHEMBL9358984

SCHEMBL9358984

CC(C)c1ccc2c(c1)c(-c1ccccc1Cl)c(C(=O)O)c(=O)n2C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.39
AKR1C3 P42330 1/20 0.39
AKR1C2 P52895 1/20 0.39
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
PTGES2 Q9H7Z7 1/20 0.39
CHEK1 O14757 2/20 0.39
WEE1 P30291 2/20 0.39
RORA P35398 1/20 0.38
RORC P51449 1/20 0.38
RORB Q92753 1/20 0.38
MAP3K5 Q99683 1/20 0.38
NPC1 O15118 1/20 0.38
POLB P06746 1/20 0.37
PABPC1 P11940 1/20 0.37
GFER P55789 1/20 0.37
LMNA P02545 1/20 0.37
PHGDH O43175 1/20 0.36
ALDH1A1 P00352 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
SCHEMBL8544707 0.86 KMT2A (0.47) KDM4EMEN1KMT2ACHEK1WEE1
SCHEMBL9358921 0.86 POLB (0.53) KDM4EL3MBTL1MEN1KMT2ANPC1
SCHEMBL8541594 0.83 KDM4E (0.44) KDM4EL3MBTL1MEN1KMT2ACHEK1
SCHEMBL9358757 0.82 EDNRB (0.42) KDM4EMEN1KMT2ACHEK1WEE1
SCHEMBL9358730 0.81 LMNA (0.44) L3MBTL1MEN1KMT2AWEE1RORC
SCHEMBL6636719 0.76 ROCK2 (0.43) L3MBTL1MEN1KMT2AWEE1MAP3K5
SCHEMBL9363440 0.76 KMT2A (0.46) KDM4EMEN1KMT2A
SCHEMBL27337810 0.75 KMT2A (0.46) KDM4EMEN1KMT2A
SCHEMBL27396929 0.74 EGFR (0.54) KDM4EL3MBTL1MEN1KMT2AMAP3K5
SCHEMBL9359029 0.74 RECQL (0.45) KDM4ENPC1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0421456-B1 Quinoline derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1994-12-28 EP disclosed
US-5223513-A Anticholesterol agent TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-06-29 US disclosed
EP-0421456-A2 Quinoline derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1991-04-10 EP disclosed