SCHEMBL11610312

SCHEMBL11610312

CC(C)c1cc(OC(=O)Cl)cc(C(C)C)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 2/20 0.39
FABP4 P15090 2/20 0.39
KDM4E B2RXH2 5/20 0.37
SMN1; SMN2 Q16637 2/20 0.35
ALDH1A1 P00352 2/20 0.35
LMNA P02545 2/20 0.35
FABP5 Q01469 1/20 0.34
EIF4A3 P38919 2/20 0.33
POLB P06746 1/20 0.33
ACHE P22303 1/20 0.33
THRB P10828 1/20 0.33
HPGD P15428 1/20 0.33
XBP1 P17861 1/20 0.33
PTGS1 P23219 1/20 0.33
MEN1 O00255 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
GABRA1 P14867 1/20 0.32
GABRB2 P47870 1/20 0.32
MAPT P10636 1/20 0.31

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
SCHEMBL5836310 0.89 KDM4E (0.49) FABP3FABP4KDM4ESMN1; SMN2ALDH1A1
SCHEMBL11611254 0.83 FABP3 (0.32) FABP3FABP4KDM4ELMNAACHE
SCHEMBL11425812 0.83 FABP3 (0.42) FABP3FABP4KDM4ESMN1; SMN2ALDH1A1
SCHEMBL11421086 0.81 LMNA (0.43) FABP3FABP4KDM4ESMN1; SMN2LMNA
SCHEMBL7058967 0.79 SMN1; SMN2 (0.53) KDM4ESMN1; SMN2ALDH1A1LMNAPOLB
SCHEMBL11475059 0.79 MEN1 (0.47) FABP3FABP4KDM4ESMN1; SMN2FABP5
SCHEMBL998315 0.77 KMT2A (0.39) KDM4ESMN1; SMN2ALDH1A1LMNAMEN1
SCHEMBL11508629 0.76 ACHE (0.53) FABP3FABP4KDM4ESMN1; SMN2ALDH1A1
SCHEMBL9575440 0.73 FABP3 (0.35) FABP3FABP4KDM4ESMN1; SMN2FABP5
SCHEMBL17471789 0.73 KDM4E (0.37) FABP3FABP4KDM4ESMN1; SMN2ALDH1A1

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-4069340-A ARYLOXY DIMETHYL IMMONIUM CHLORIDES FROM DIMETHYL FORMAMIDE AND CORRESPONDING ARYL CHLOROFORMATES HOOKER CHEMICALS & PLASTICS CORPORATION (US) 1978-01-17 US disclosed
US-3983178-A Immonium salts and derivatives thereof HOOKER CHEMICALS & PLASTICS CORPORATION (US) 1976-09-28 US disclosed