SCHEMBL10489059

SCHEMBL10489059

CCCCCCCCCCCC(CCCCCC)CNC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.52
EPHX1 P07099 1/20 0.46
TSHR P16473 2/20 0.44
ALDH1A1 P00352 1/20 0.44
CYP3A4 P08684 1/20 0.44
DNM1 Q05193 2/20 0.40
THRB P10828 1/20 0.40
LCK P06239 1/20 0.40
PPARD Q03181 1/20 0.40
ZDHHC20 Q5W0Z9 1/20 0.40
ZDHHC2 Q9UIJ5 1/20 0.40
S1PR2 O95136 5/20 0.39
S1PR1 P21453 5/20 0.39
S1PR3 Q99500 5/20 0.39
S1PR4 O95977 4/20 0.39
ADH1B P00325 1/20 0.39
ADH1C P00326 1/20 0.39
ADH1A P07327 1/20 0.39
ADH4 P08319 1/20 0.39
ADH7 P40394 1/20 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
SCHEMBL116469 1.00 LMNA (0.52) LMNAEPHX1TSHRALDH1A1CYP3A4
SCHEMBL12320427 1.00 LMNA (0.52) LMNAEPHX1TSHRALDH1A1CYP3A4
SCHEMBL24219829 1.00 LMNA (0.52) LMNAEPHX1TSHRALDH1A1CYP3A4
Bromide SCHEMBL9619162 0.98 LMNA (0.50) LMNAEPHX1TSHRALDH1A1CYP3A4
SCHEMBL20718611 0.98 LMNA (0.50) LMNAEPHX1TSHRALDH1A1CYP3A4
SCHEMBL22857636 0.95 LMNA (0.48) LMNAEPHX1TSHRALDH1A1CYP3A4
SCHEMBL24850078 0.95 ALDH1A1 (0.50) LMNAEPHX1TSHRALDH1A1CYP3A4
SCHEMBL2179490 0.93 LMNA (0.44) LMNAEPHX1TSHRALDH1A1CYP3A4
SCHEMBL25992548 0.91 ALDH1A1 (0.58) LMNAEPHX1TSHRALDH1A1CYP3A4
SCHEMBL18426286 0.91 ALDH1A1 (0.58) LMNAEPHX1TSHRALDH1A1CYP3A4

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-4849257-A POLYMERIC ANTISOILANT, DISPERSANT, FABRIC SOFTENER THE PROCTER & GAMBLE COMPANY (US) 1989-07-18 US disclosed