SCHEMBL9053187

SCHEMBL9053187

CCC(C)(C)C(=O)c1cc[c]cc1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 15/20 0.36
MLYCD O95822 4/20 0.33
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.32

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
SCHEMBL12948138 0.85 MLYCD (0.42) RIPK1MLYCD
SCHEMBL9787049 0.82 POLB (0.36) MLYCDPOLB
SCHEMBL9787050 0.80 MLYCD (0.37) MLYCD
SCHEMBL14135048 0.79 MAPT (0.44) RIPK1MLYCD
SCHEMBL6223670 0.79 RIPK1 (0.50) RIPK1LMNAPOLB
SCHEMBL12948128 0.79 PGR (0.39) RIPK1MLYCD
SCHEMBL7189485 0.79 PGR (0.41) MLYCD
SCHEMBL5471636 0.78 ALDH1A1 (0.52)
SCHEMBL14390414 0.78 MLYCD (0.38) RIPK1MLYCD
SCHEMBL18792784 0.78 HSD17B3 (0.48) LMNA

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
WO-1996009046-A1 5α-REDUCTASE INHIBITORS ELI LILLY AND COMPANY (US) 1996-03-28 WO disclosed