SCHEMBL2321965

SCHEMBL2321965

CC1CCN(C(=O)c2c[c]ccc2)CC1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.67
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54
HPGD P15428 6/20 0.52
ALDH1A1 P00352 3/20 0.52
TP53 P04637 1/20 0.52
GRM5 P41594 2/20 0.52
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA7 P43166 1/20 0.50
CA9 Q16790 1/20 0.50
CA14 Q9ULX7 1/20 0.50
KMT2A Q03164 2/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
TSHR P16473 1/20 0.48
GAA P10253 1/20 0.47
KDM4E B2RXH2 1/20 0.44
APOBEC3A P31941 1/20 0.43
APOBEC3G Q9HC16 1/20 0.43

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
SCHEMBL1920680 0.85 ALDH1A1 (0.49) HPGDALDH1A1TP53CA12CA1
SCHEMBL28291402 0.85 ACHE (0.46) ACHEHPGDKMT2ASMN1; SMN2EPHX1
SCHEMBL27991527 0.84 L3MBTL3 (0.66) ACHEEPHX1
SCHEMBL7428185 0.84 MAPT (0.56) ACHENPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL1921183 0.82 HPGD (0.55) HPGDALDH1A1KMT2ASMN1; SMN2
SCHEMBL1298628 0.82 HPGD (0.59) HPGDALDH1A1KMT2ASMN1; SMN2GAA
SCHEMBL1298702 0.81 POLB (0.54) NPC1HPGDGRM5KMT2ATSHR
SCHEMBL7002476 0.81 HSP90AA1 (0.44) ACHEHPGDALDH1A1TP53KMT2A
SCHEMBL28292825 0.81 L3MBTL3 (0.59) ALDH1A1KMT2ASMN1; SMN2KDM4E
SCHEMBL1298971 0.81 HPGD (0.62) HPGDALDH1A1CA12CA1CA2

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
WO-2011094890-A1 PHENYLALANINE DERIVATIVES AND THEIR USE AS NON-PEPTIDE GLP-1 RECEPTOR MODULATORS ARGUSINA INC. (US) 2011-08-11 WO disclosed