SCHEMBL9879635

SCHEMBL9879635

CC(C(=O)c1ccccc1)N1CC=C(c2cccc(C(F)(F)F)c2)CC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
MAPT P10636 3/20 0.47
THRB P10828 1/20 0.47
CCR2 P41597 1/20 0.47
SOS1 Q07889 1/20 0.46
PPARG P37231 1/20 0.45
PPARA Q07869 1/20 0.45
KDM4E B2RXH2 2/20 0.42
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
GAA P10253 1/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
KCNH2 Q12809 2/20 0.42
HRH3 Q9Y5N1 1/20 0.42
CNR2 P34972 1/20 0.41
HTR2C P28335 2/20 0.41
HTR7 P34969 1/20 0.41
CHRNB2 P17787 2/20 0.40

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
SCHEMBL4588833 0.77 PPARG (0.44) MEN1KMT2AMAPTTHRBCCR2
SCHEMBL4589034 0.77 PPARG (0.44) MEN1KMT2AMAPTCCR2SOS1
SCHEMBL4845324 0.77 HTR2C (0.41) MEN1KMT2AMAPTCCR2SOS1
SCHEMBL9167916 0.76 SLC6A4 (0.44) MEN1KMT2AMAPTCCR2SOS1
SCHEMBL2930491 0.76 CCR2 (0.51) MEN1KMT2AMAPTCCR2SOS1
SCHEMBL9879636 0.74 SIGMAR1 (0.74) PPARGPPARAHTR7
SCHEMBL6320725 0.74 LMNA (0.55) MEN1KMT2AMAPTLMNAPOLB
SCHEMBL10975299 0.74 HTR2C (0.43) MEN1KMT2AMAPTCCR2SOS1
SCHEMBL4587602 0.74 SOS1 (0.49) MEN1KMT2AMAPTCCR2SOS1
Hydrochloric Acid SCHEMBL9992562 0.73 LMNA (0.54) MEN1KMT2AMAPTTHRBLMNA

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-1991008200-A1 NOVEL TETRAHYDROPYRIDINE DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING SUCH COMPOUNDS AS ACTIVE AGENTS Richter Gedeon Vegyészeti Gyár Rt. (HU) 1991-06-13 WO claimed