SCHEMBL9986642

SCHEMBL9986642

CCn1c2ccccc2c2cc(CN3CC(C)CC(C)C3)ccc21

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 8/20 0.64
MAPT P10636 7/20 0.64
SMN1; SMN2 Q16637 3/20 0.59
THRB P10828 1/20 0.59
GAA P10253 1/20 0.57
FAAH O00519 1/20 0.55
MCHR2 Q969V1 5/20 0.55
LMNA P02545 4/20 0.55
KDM4E B2RXH2 3/20 0.55
ALDH1A1 P00352 2/20 0.55
MCHR1 Q99705 1/20 0.53
HPGD P15428 1/20 0.52
TSHR P16473 1/20 0.52
ALOX12 P18054 1/20 0.52
HTT P42858 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
POLB P06746 1/20 0.51
MAPK1 P28482 1/20 0.51
CNR2 P34972 1/20 0.51

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
SCHEMBL9986423 0.85 TP53 (0.62) TP53MAPTSMN1; SMN2THRBGAA
SCHEMBL9987463 0.85 TP53 (0.71) TP53MAPTSMN1; SMN2THRBGAA
SCHEMBL9986187 0.81 TP53 (0.78) TP53MAPTSMN1; SMN2THRBGAA
SCHEMBL27275930 0.80 MAPT (0.68) TP53MAPTSMN1; SMN2THRBGAA
SCHEMBL9987715 0.79 TP53 (0.79) TP53MAPTSMN1; SMN2THRBGAA
SCHEMBL9986903 0.79 TP53 (0.70) TP53MAPTSMN1; SMN2THRBGAA
SCHEMBL9986621 0.78 TP53 (0.73) TP53MAPTSMN1; SMN2THRBGAA
SCHEMBL9986789 0.78 TP53 (0.73) TP53MAPTSMN1; SMN2THRBGAA
SCHEMBL12158838 0.76 KDM4E (0.66) TP53MAPTSMN1; SMN2THRBGAA
SCHEMBL10163400 0.76 KDM4E (0.66) TP53MAPTSMN1; SMN2THRBGAA

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
US-8080566-B1 Carbazole inhibitors of histamine receptors for the treatment of disease KALYPSYS, INC (US) 2011-12-20 US disclosed
US-8080566-B1 Carbazole inhibitors of histamine receptors for the treatment of disease KALYPSYS, INC (US) 2011-12-20 US disclosed
US-8080566-B1 Carbazole inhibitors of histamine receptors for the treatment of disease KALYPSYS, INC (US) 2011-12-20 US disclosed