SCHEMBL11223714

SCHEMBL11223714

Cc1ccc(OC(=O)c2cccc(C(=O)Oc3ccc(C)cc3Cl)c2-c2ccccc2)c(Cl)c1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 1/20 0.49
FABP4 P15090 1/20 0.49
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
PKM P14618 1/20 0.45
MRGPRX4 Q96LA9 1/20 0.44
CYP1A2 P05177 2/20 0.42
MAPT P10636 1/20 0.42
CYP2C19 P33261 1/20 0.42
LMNA P02545 2/20 0.41
ALOX15 P16050 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KDM4E B2RXH2 1/20 0.41
CYP2C9 P11712 1/20 0.41
HSD17B10 Q99714 1/20 0.41
KMT2A Q03164 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
SCHEMBL11223717 0.96 FABP4 (0.52) FABP3FABP4NPC1RAB9APKM
SCHEMBL11228704 0.83 PTK2B (0.57) FABP3FABP4NPC1RAB9APKM
SCHEMBL10500437 0.80 MRGPRX4 (0.53) NPC1RAB9APKMMRGPRX4CYP1A2
SCHEMBL11229789 0.80 NPC1 (0.47) NPC1RAB9APKMMRGPRX4LMNA
SCHEMBL11228708 0.79 PTK2B (0.54) FABP3FABP4CYP1A2MAPTLMNA
SCHEMBL11229792 0.79 MRGPRX4 (0.48) FABP3FABP4NPC1RAB9APKM
SCHEMBL31321622 0.75 MAPT (0.58) NPC1RAB9ACYP1A2MAPTCYP2C19
SCHEMBL22471651 0.74 KMT2A (0.42) NPC1RAB9APKMMRGPRX4MAPT
SCHEMBL11136316 0.73 POLB (0.48) NPC1RAB9APKMMRGPRX4MAPT
SCHEMBL11137359 0.72 MRGPRX4 (0.47) RAB9AMRGPRX4MAPTCYP2C19L3MBTL1

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-4329443-A Process for polyester-carbonate transesterifications GENERAL ELECTRIC COMPANY (US) 1982-05-11 US disclosed