SCHEMBL8506366

SCHEMBL8506366

CCCC1(CN)c2ccccc2CCc2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 3/20 0.46
LMNA P02545 1/20 0.41
SIGMAR1 Q99720 7/20 0.38
KDM1A O60341 3/20 0.38
EBP Q15125 1/20 0.36
MAOB P27338 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CHRM2 P08172 1/20 0.35
ADRA2A P08913 1/20 0.35
RET P07949 1/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL8504242 0.79 LMNA (0.49) HTR2ALMNASIGMAR1KDM1AEBP
SCHEMBL8505464 0.78 LMNA (0.44) LMNASIGMAR1KDM1AEBPMAPK1
SCHEMBL8506210 0.77 LMNA (0.37) HTR2ALMNASIGMAR1KDM1AEBP
SCHEMBL8507603 0.76 LMNA (0.64) HTR2ALMNASIGMAR1MEN1KMT2A
SCHEMBL19505650 0.74 LMNA (0.63) HTR2ALMNASIGMAR1KDM1AEBP
SCHEMBL9280563 0.71 SIGMAR1 (0.44) HTR2ASIGMAR1KDM1AEBPMAOB
SCHEMBL7330436 0.71 SIGMAR1 (0.44) HTR2ASIGMAR1KDM1AEBPMAOB
SCHEMBL7782464 0.70 ESR2 (0.48) LMNASIGMAR1KDM1AEBPMAOB
SCHEMBL8256736 0.69 LMNA (0.53) HTR2ALMNAKDM1AMAOBMEN1
Ammonia Solution, Strong SCHEMBL27550700 0.69 ESR2 (0.47) LMNASIGMAR1KDM1AEBPMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0733035-B1 TRICYCLIC DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SCHERING CORP (US) 1999-03-31 EP disclosed
EP-0733035-A1 TRICYCLIC DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SCHERING CORPORATION (US) 1996-09-25 EP disclosed
US-5538986-A INHIBITORS OF TUMOR NECROSIS FACTOR-ALPHA, DIBENZOCYCLOHEPTANE AND DIBENZOXEPINE DERIVATIVES SCHERING CORPORATION (US) 1996-07-23 US disclosed
WO-1995015939-A1 TRICYCLIC DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SCHERING CORPORATION (US) 1995-06-15 WO disclosed