SCHEMBL8965948

SCHEMBL8965948

CCC(C)OC(=O)C(N)CCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.48
CTSC P53634 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
TSHR P16473 1/20 0.44
ANPEP P15144 2/20 0.43
ERAP1 Q9NZ08 2/20 0.43
KMT2A Q03164 2/20 0.43
ERAP2 Q6P179 2/20 0.43
MEN1 O00255 1/20 0.42
HTT P42858 1/20 0.42
HPGD P15428 1/20 0.42
LNPEP Q9UIQ6 4/20 0.42
METAP2 P50579 1/20 0.42
METAP1 P53582 1/20 0.42
GRIK1 P39086 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
SCHEMBL15989087 0.86 TSHR (0.51) CTSCSMN1; SMN2TSHRANPEPERAP1
SCHEMBL8966373 0.86 TSHR (0.51) CTSCSMN1; SMN2TSHRANPEPERAP1
SCHEMBL20747685 0.85 ALPI (0.54) MAPTCTSCANPEP
SCHEMBL20747639 0.85 ALPI (0.54) MAPTCTSCANPEP
SCHEMBL2673427 0.84 MAPT (0.49) MAPTSMN1; SMN2TSHRKMT2AMEN1
SCHEMBL2635410 0.81 SMN1; SMN2 (0.55) MAPTCTSCSMN1; SMN2ANPEPERAP1
SCHEMBL8174213 0.81 SMN1; SMN2 (0.55) MAPTCTSCSMN1; SMN2ANPEPERAP1
SCHEMBL3712742 0.81 SMN1; SMN2 (0.55) MAPTCTSCSMN1; SMN2ANPEPERAP1
SCHEMBL7057015 0.81 MAPT (0.47) MAPTSMN1; SMN2TSHRKMT2AMEN1
SCHEMBL14434512 0.81 ERAP2 (0.44) SMN1; SMN2TSHRANPEPERAP1KMT2A

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-5552317-A POLYMERIZATION OF MONOMERS IN THE PRESENCE OF ENZYME AND HYDROLYSIS INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 1996-09-03 US disclosed
US-5552318-A ENANTIOSELECTIVE SYNTHESIS OF D-AMINO ACIDS INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 1996-09-03 US disclosed