SCHEMBL9411933

SCHEMBL9411933

OCN1CCc2ccc3occc3c21

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 4/20 0.40
HTR2A P28223 3/20 0.40
HTR2B P41595 3/20 0.40
SIGMAR1 Q99720 10/20 0.35
HTR1A P08908 1/20 0.34
DRD3 P35462 1/20 0.34
MAOB P27338 3/20 0.32
NFKB1 P19838 1/20 0.32
MAOA P21397 1/20 0.32
EED O75530 1/20 0.32
ACHE P22303 3/20 0.30
BCHE P06276 1/20 0.30

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
SCHEMBL5743895 0.84 HTR2C (0.40) HTR2CHTR2AHTR2BSIGMAR1HTR1A
SCHEMBL7600224 0.79 HTR2C (0.42) HTR2CHTR2AHTR2BSIGMAR1HTR1A
Ammonia Solution, Strong SCHEMBL14677992 0.78 HTR2C (0.41) HTR2CHTR2AHTR2BSIGMAR1HTR1A
SCHEMBL30000911 0.76 HTR2C (0.42) HTR2CHTR2AHTR2BSIGMAR1HTR1A
SCHEMBL4429415 0.61 PAX8 (0.48) HTR2CHTR2AHTR2BMAOBNFKB1
SCHEMBL13983903 0.60 HTR2C (0.66) HTR2CHTR2AHTR2BHTR1ADRD3
SCHEMBL3633037 0.59 HTR2A (0.46) HTR2CHTR2AHTR2BHTR1ADRD3
SCHEMBL1555111 0.58 HTR2A (0.45) HTR2CHTR2AHTR2BSIGMAR1HTR1A
SCHEMBL9411925 0.58 HTR2C (0.57) HTR2CHTR2AHTR2BHTR1ADRD3
SCHEMBL15465932 0.57 PAX8 (0.45) HTR2CHTR2AHTR2BMAOBNFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0586254-A1 Furanoindoline derivatives and their use as antitumor agents ELI LILLY AND COMPANY (US) 1994-03-09 EP disclosed
US-5248691-A Antitumor agent ELI LILLY AND COMPANY (US) 1993-09-28 US disclosed