SCHEMBL18568367

SCHEMBL18568367

CON=C1CC2C(=O)C(c3c(C)cc(C)cc3C)C(=O)C2C1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
MAPT P10636 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
SCHEMBL12885590 0.84
SCHEMBL449804 0.77 F2 (0.31)
SCHEMBL449805 0.77 F2 (0.31)
SCHEMBL10326929 0.71
SCHEMBL15839585 0.65 SLC6A3 (0.31) ALDH1A1
SCHEMBL13366559 0.64
SCHEMBL986581 0.63 UGT2B17 (0.33) ALDH1A1MAPT
SCHEMBL449518 0.62 SMN1; SMN2 (0.42) ALDH1A1MAPT
SCHEMBL449604 0.62 SMN1; SMN2 (0.42) ALDH1A1MAPT
SCHEMBL10199892 0.61 TAS1R3 (0.33) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2334175-B1 PHENYL-SUBSTITUTED BICYCLOOCTANE 1,3 DIONE DERIVATIVES BAYER IP GMBH (DE) 2017-03-01 EP disclosed