SCHEMBL9858334

SCHEMBL9858334

COC(=O)C1(C(=O)c2ccccc2)CC=CC=C1c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
CHRM1 P11229 1/20 0.36
CYP3A4 P08684 2/20 0.35
KMT2A Q03164 5/20 0.35
MEN1 O00255 3/20 0.35
SRC P12931 1/20 0.34
LMNA P02545 2/20 0.33
CES2 O00748 1/20 0.33
CES1 P23141 1/20 0.33
POLB P06746 2/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
NPC1 O15118 4/20 0.32
RAB9A P51151 4/20 0.32
HPGD P15428 1/20 0.32
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 2/20 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
SCHEMBL28172298 0.90 MEN1 (0.39) TSHRCHRM1CYP3A4KMT2AMEN1
SCHEMBL9052363 0.87 KMO (0.36) TSHRCYP3A4KMT2AMEN1LMNA
SCHEMBL9861595 0.77 SMN1; SMN2 (0.35) CYP3A4KMT2AMEN1LMNAALDH1A1
SCHEMBL505430 0.77 AKR1C1 (0.35) KMT2AMEN1NPC1RAB9ASMN1; SMN2
SCHEMBL28737049 0.76 SMN1; SMN2 (0.47) SMN1; SMN2OPRM1
SCHEMBL28176754 0.76 PDCD1 (0.41) TSHRKMT2AMEN1LMNAALDH1A1
SCHEMBL27599522 0.75 AKR1C1 (0.34) KMT2AMEN1NPC1RAB9ASMN1; SMN2
SCHEMBL28965232 0.75 MAPT (0.40) TSHRCHRM1CYP3A4KMT2AMEN1
SCHEMBL30223732 0.73 KMO (0.34) TSHRCYP3A4KMT2AMEN1LMNA
SCHEMBL7684826 0.71 USP2 (0.34) TSHRCYP3A4KMT2AMEN1ALDH1A1

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
EP-0407808-A2 Catalyst, process for preparation of same, and process for polymerization of olefins using same SHOWA DENKO KABUSHIKI KAISHA (JP) 1991-01-16 EP disclosed