SCHEMBL9445799

SCHEMBL9445799

C=CCC1C(=O)CC(C)CC1C

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 2/20 0.33
CTRC Q99895 2/20 0.33
F2 P00734 1/20 0.33

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
SCHEMBL7619973 0.77 FAAH (0.34)
SCHEMBL21601874 0.77 PRSS1 (0.39) PRSS1CTRCF2
SCHEMBL26466558 0.77 PRSS1 (0.39) PRSS1CTRCF2
SCHEMBL10939581 0.77 PRSS1 (0.39) PRSS1CTRCF2
SCHEMBL18022061 0.76 PRSS1 (0.34) PRSS1CTRCF2
SCHEMBL14503064 0.74 PRSS1 (0.40) PRSS1CTRCF2
SCHEMBL11431438 0.72 ALDH1A1 (0.41) PRSS1CTRCF2
SCHEMBL10689074 0.70 PRSS1 (0.33) PRSS1CTRCF2
SCHEMBL18250958 0.68 ALDH1A1 (0.33)
SCHEMBL11431872 0.67 PRSS1 (0.32) PRSS1CTRCF2

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-5216175-A Polyoxoheterocyclic tetracylic derivatives SRI INTERNATIONAL (US) 1993-06-01 US disclosed
EP-0479970-A1 ANTIMALARIAL ANALOGS OF ARTEMISININ SRI INTERNATIONAL (US) 1992-04-15 EP disclosed
WO-1991014689-A1 ANTIMALARIAL ANALOGS OF ARTEMISININ SRI INTERNATIONAL (US) 1991-10-03 WO disclosed