SCHEMBL9653786

SCHEMBL9653786

O=C(C=Cc1ccc(C(F)(F)F)cc1)N1CCC(O)CC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR183 P32249 3/20 0.60
LMNA P02545 4/20 0.60
HPGD P15428 3/20 0.60
GAA P10253 2/20 0.60
CYP1A2 P05177 1/20 0.58
KCNH2 Q12809 1/20 0.54
HRH3 Q9Y5N1 1/20 0.54
ALDH1A1 P00352 5/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
NPC1 O15118 3/20 0.53
RAB9A P51151 3/20 0.53
MAPT P10636 2/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
CCR2 P41597 2/20 0.51
TP53 P04637 2/20 0.50
HDAC3 O15379 1/20 0.50
ADAM17 P78536 1/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC2 Q92769 1/20 0.50

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
SCHEMBL9653792 1.00 GPR183 (0.60) GPR183LMNAHPGDGAACYP1A2
SCHEMBL9654393 0.88 HPGD (0.78) GPR183LMNAHPGDGAACYP1A2
SCHEMBL9654396 0.88 HPGD (0.78) GPR183LMNAHPGDGAACYP1A2
SCHEMBL19385657 0.83 GPR183 (0.67) GPR183LMNAHPGDGAACYP1A2
SCHEMBL19385656 0.83 GPR183 (0.67) GPR183LMNAHPGDGAACYP1A2
SCHEMBL1615026 0.83 GPR183 (0.63) GPR183LMNAHPGDGAACYP1A2
SCHEMBL16599253 0.83 GPR183 (0.63) GPR183LMNAHPGDGAACYP1A2
SCHEMBL16599255 0.83 GPR183 (0.63) GPR183LMNAHPGDGAACYP1A2
SCHEMBL1615028 0.83 GPR183 (0.63) GPR183LMNAHPGDGAACYP1A2
SCHEMBL9654409 0.82 RAB9A (0.75) GPR183HPGDCYP1A2ALDH1A1SMN1; SMN2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0192431-B1 AGENT FOR CEREBRAL PROTECTION KYOWA HAKKO KOGYO KABUSHIKI KAISHA (JP) 1992-12-16 EP disclosed
US-4962107-A IMPROVED SIDE EFFECT REDUCTION KYOWA HAKKO KOGYO KABUSHIKI KAISHA (JP) 1990-10-09 US disclosed
US-4824842-A Cinnamoyl piperidines and thiomorpholine and cerebral protection compositions KYOWA HAKKO KOGYO KABUSHIKI KAISHA (JP) 1989-04-25 US disclosed