SCHEMBL9305014

SCHEMBL9305014

CN1CC(=Cc2ccccc2)C(=O)C(=Cc2ccccc2)C1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.66
HTT P42858 3/20 0.66
LMNA P02545 3/20 0.66
SMN1; SMN2 Q16637 2/20 0.66
RAB9A P51151 2/20 0.66
MITF O75030 2/20 0.66
CYP1A2 P05177 2/20 0.62
ACHE P22303 5/20 0.61
BCHE P06276 1/20 0.61
KDM4E B2RXH2 2/20 0.60
MAPK1 P28482 3/20 0.58
IKBKB O14920 1/20 0.58
RAF1 P04049 1/20 0.58
RPS6KB1 P23443 1/20 0.58
AKT1 P31749 1/20 0.58
AKT2 P31751 1/20 0.58
KDR P35968 1/20 0.58
MAPKAPK2 P49137 1/20 0.58
PRKAG1 P54619 1/20 0.58
MAP2K1 Q02750 1/20 0.58

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
SCHEMBL9305010 1.00 MAPT (0.66) MAPTHTTLMNASMN1; SMN2RAB9A
SCHEMBL22822883 1.00 MAPT (0.66) MAPTHTTLMNASMN1; SMN2RAB9A
Dimethylamine SCHEMBL8372694 0.95 MAPT (0.60) MAPTHTTLMNASMN1; SMN2RAB9A
Diethylamine SCHEMBL8377295 0.89 MAPT (0.55) MAPTHTTLMNASMN1; SMN2RAB9A
SCHEMBL22550766 0.83 ACHE (0.64) MAPTHTTLMNASMN1; SMN2RAB9A
SCHEMBL31518789 0.83 ACHE (0.64) MAPTHTTLMNASMN1; SMN2RAB9A
SCHEMBL24733669 0.83 MAPT (0.49) MAPTHTTLMNASMN1; SMN2RAB9A
SCHEMBL17899562 0.81 DRD3 (0.66) MAPTHTTLMNASMN1; SMN2RAB9A
SCHEMBL13036875 0.81 HTT (0.67) MAPTHTTLMNASMN1; SMN2RAB9A
SCHEMBL11608460 0.81 ACHE (0.62) MAPTHTTLMNASMN1; SMN2RAB9A

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
US-5332819-A Photobleachable initiator systems E.I. DU PONT DE NEMOURS AND COMPANY (US) 1994-07-26 US disclosed
US-5217846-A Photopolymerizable compostion containing an addition polymerizable unsaturated initiator, a coinitiater and a sensitizer E. I. DU PONT DE NEMOURS AND COMPANY (US) 1993-06-08 US disclosed
US-4085102-A CNS DEPRESSANTS, MUSCLE RELAXANTS E. R. SQUIBB & SONS, INC. (US) 1978-04-18 US disclosed
US-4065617-A ANTIINFLAMMATORY E. R. SQUIBB & SONS, INC. (US) 1977-12-27 US disclosed