SCHEMBL11670565

SCHEMBL11670565

CCCCOC(CCC)C(CC)CO

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.45
ALDH1A1 P00352 2/20 0.38
TSHR P16473 2/20 0.34
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
USP2 O75604 1/20 0.32
MGAM O43451 3/20 0.31

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
SCHEMBL28175663 0.81 USP2 (0.43) LMNAALDH1A1CNR1CNR2USP2
SCHEMBL15062520 0.79 CYP3A4 (0.40) TSHRUSP2
SCHEMBL17792592 0.77 TSHR (0.44) LMNAALDH1A1TSHRCNR1CNR2
SCHEMBL8607950 0.75 LMNA (0.52) LMNAALDH1A1TSHR
SCHEMBL16177164 0.75 TSHR (0.34) ALDH1A1TSHRCNR1CNR2USP2
SCHEMBL27802090 0.74 MGAM (0.43) LMNAALDH1A1TSHRCNR1CNR2
SCHEMBL27956723 0.74 LMNA (0.50) LMNAALDH1A1TSHR
SCHEMBL28235987 0.74 LMNA (0.50) LMNAALDH1A1TSHR
SCHEMBL10406158 0.74 TSHR (0.33) ALDH1A1TSHRMGAM
SCHEMBL13010806 0.73 LMNA (0.33) 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
US-4040977-A HALOACETAMIDE OR THIOCYANOACETAMIDE-ALCOHOL-FORMALDEHYDE CONDENSATES STERLING DRUG INC. (US) 1977-08-09 US disclosed