SCHEMBL7993604

SCHEMBL7993604

O=C1CCC2Cc3ccccc3C2C1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 9/20 0.41
SRD5A1 P18405 2/20 0.40
HTR2A P28223 6/20 0.39
HTR2C P28335 6/20 0.39
HTR2B P41595 6/20 0.39
HRH3 Q9Y5N1 5/20 0.39

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
SCHEMBL6169947 0.89 SIGMAR1 (0.47) SIGMAR1SRD5A1
SCHEMBL7706950 0.89 SIGMAR1 (0.47) SIGMAR1SRD5A1
SCHEMBL7709441 0.86 SIGMAR1 (0.47) SIGMAR1SRD5A1
SCHEMBL7709439 0.86 SIGMAR1 (0.47) SIGMAR1SRD5A1
SCHEMBL8051810 0.86 SIGMAR1 (0.47) SIGMAR1SRD5A1
SCHEMBL6266061 0.84 SIGMAR1 (0.50) SIGMAR1SRD5A1
SCHEMBL11653286 0.79 SRD5A1 (0.43) SRD5A1HTR2AHTR2C
SCHEMBL7091597 0.77 PLAU (0.41)
SCHEMBL7091599 0.77 PLAU (0.41)
SCHEMBL7091601 0.77 PLAU (0.41)

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
WO-2001014334-A1 FLUORENONE COMPOUNDS WITH MODIFIED 7-POSITION SUBSTITUENTS FOR TREATING AND PREVENTING BRAIN AND SPINAL INJURY QUESTCOR PHARMACEUTICALS, INC. (US) 2001-03-01 WO disclosed
US-4113726-A HYPOTENSIVE AGENTS E. R. SQUIBB & SONS, INC. (US) 1978-09-12 US disclosed
US-3984419-A HYPOTENSIVES E. R. SQUIBB & SONS, INC. (US) 1976-10-05 US disclosed