SCHEMBL8971592

SCHEMBL8971592

CC(CN1CCCC1)Oc1ccccc1CC(=O)N1CC2C(F)CCC(c3ccccc3)(c3ccccc3)C2C1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FNTA P49354 7/20 0.53
FNTB P49356 7/20 0.53
TACR1 P25103 5/20 0.38
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
CYP3A4 P08684 1/20 0.38
MAPT P10636 1/20 0.38
TSHR P16473 1/20 0.38
CYP2C19 P33261 1/20 0.38
POLB P06746 1/20 0.35
HTR1A P08908 2/20 0.34
ADRA1D P25100 2/20 0.34
ADRA1A P35348 2/20 0.34
ADRA1B P35368 2/20 0.34

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
SCHEMBL9003180 1.00 FNTA (0.53) FNTAFNTBTACR1KMT2AMEN1
SCHEMBL9269007 1.00 FNTA (0.53) FNTAFNTBTACR1KMT2AMEN1
SCHEMBL9270252 0.87 LTA4H (0.46) FNTAFNTBTSHRPOLB
SCHEMBL9266283 0.84 FNTA (0.71) FNTAFNTBTACR1KMT2AMEN1
SCHEMBL8970958 0.84 FNTA (0.71) FNTAFNTBTACR1KMT2AMEN1
Hydrochloric Acid SCHEMBL9274389 0.83 FNTA (0.50) FNTAFNTBTACR1KMT2AMEN1
SCHEMBL8998016 0.82 FNTA (0.45) FNTAFNTBTACR1KMT2AMEN1
SCHEMBL9268765 0.80 FNTA (0.49) FNTAFNTBTACR1KMT2APOLB
SCHEMBL9002982 0.80 FNTA (0.49) FNTAFNTBTACR1KMT2APOLB
Hydrochloric Acid SCHEMBL9268707 0.79 FNTA (0.51) FNTAFNTBTACR1KMT2AMEN1

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-0586490-B1 DERIVATIVES OF PERHYDROISOINDOL, THEIR PREPARATION, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM RHONE POULENC RORER SA (FR) 1996-03-20 EP claimed
US-5451601-A Perhydroisoindole derivatives and pharmaceutical compositions containing them RHONE-POULENC RORER S.A. (FR) 1995-09-19 US claimed
US-5451601-A Perhydroisoindole derivatives and pharmaceutical compositions containing them RHONE-POULENC RORER S.A. (FR) 1995-09-19 US disclosed