SCHEMBL19953601

SCHEMBL19953601

CC1C(=O)N(C2CC2)c2cc(F)ccc2C1C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 3/20 0.35
MC4R P32245 1/20 0.35
KMT2A Q03164 2/20 0.34
GRIA1 P42261 1/20 0.34
GRIA2 P42262 1/20 0.34
GRIA3 P42263 1/20 0.34
GRIA4 P48058 1/20 0.34
TSHR P16473 1/20 0.34
BRD4 O60885 2/20 0.34
OPRM1 P35372 2/20 0.34
OPRL1 P41146 2/20 0.34
MAPK1 P28482 1/20 0.34
FFAR4 Q5NUL3 2/20 0.33
MEN1 O00255 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HTR7 P34969 1/20 0.33

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
SCHEMBL19960817 0.86 GRIA1 (0.34) KMT2AGRIA1GRIA2GRIA3GRIA4
SCHEMBL19960818 0.81 PER2 (0.33) KMT2AOPRM1OPRL1MEN1
SCHEMBL19960710 0.81 GRM7 (0.41) MC4RKMT2ATSHRMEN1
SCHEMBL10063160 0.71 OPRM1 (0.42) OPRM1OPRL1
SCHEMBL10063154 0.63 OPRM1 (0.42) GRIA1GRIA2GRIA3GRIA4OPRM1
SCHEMBL23034824 0.62 MEN1 (0.50) KMT2ATSHROPRM1OPRL1MEN1
SCHEMBL26688764 0.60 GRIA1 (0.37) KMT2AGRIA1GRIA2GRIA3GRIA4
SCHEMBL8668032 0.59 MEN1 (0.33) KMT2ATSHRFFAR4MEN1KDM4E
SCHEMBL30545928 0.59 KDM4E (0.39) TSHRKDM4E
SCHEMBL28356611 0.59 NOTUM (0.62) BRD4KDM4E

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-2018047983-A1 INDANE DERIVATIVES USEFUL AS MODULATORS OF MGLUR7 TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-03-15 WO disclosed