SCHEMBL11050372

SCHEMBL11050372

C=CCC(CCCC)CCCCCCCCCCCCCCCC

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.48
TSHR P16473 6/20 0.46
DNM1 Q05193 2/20 0.42
ALDH1A1 P00352 4/20 0.39
TDP1 Q9NUW8 1/20 0.38
FAAH O00519 1/20 0.37
CYP3A4 P08684 1/20 0.37
ADH1B P00325 1/20 0.36
ADH1C P00326 1/20 0.36
ADH1A P07327 1/20 0.36
ADH4 P08319 1/20 0.36
ADH7 P40394 1/20 0.36
THRB P10828 1/20 0.36
CA2 P00918 1/20 0.36
OPRM1 P35372 1/20 0.36

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
SCHEMBL25178105 1.00 LMNA (0.48) LMNATSHRDNM1ALDH1A1TDP1
SCHEMBL25185229 1.00 LMNA (0.48) LMNATSHRDNM1ALDH1A1TDP1
SCHEMBL25171262 1.00 LMNA (0.48) LMNATSHRDNM1ALDH1A1TDP1
SCHEMBL25182480 0.98 LMNA (0.44) LMNATSHRDNM1ALDH1A1TDP1
SCHEMBL25182517 0.98 LMNA (0.50) LMNATSHRDNM1ALDH1A1FAAH
SCHEMBL9445614 0.98 LMNA (0.50) LMNATSHRDNM1ALDH1A1FAAH
SCHEMBL15687620 0.98 LMNA (0.50) LMNATSHRDNM1ALDH1A1FAAH
SCHEMBL25178065 0.98 LMNA (0.50) LMNATSHRDNM1ALDH1A1FAAH
SCHEMBL25181795 0.98 LMNA (0.50) LMNATSHRDNM1ALDH1A1FAAH
SCHEMBL11766872 0.95 LMNA (0.46) LMNATSHRDNM1ALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4431836-A Hydrogenation using chitin and chitosan based immobilized metal catalysts UOP INC. (US) 1984-02-14 US disclosed
US-4367355-A Hydrogenation using chitin and chitosan based immobilized metal catalysts UOP INC. (US) 1983-01-04 US disclosed