SCHEMBL24595495

SCHEMBL24595495

CN(C)CCCC1CCCCCCCCCC1

nearest known ligand 0.83

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.83
CYP1A2 P05177 1/20 0.56
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39
PKM P14618 1/20 0.39
KDM5A P29375 3/20 0.39
PHF8 Q9UPP1 3/20 0.39
KDM2A Q9Y2K7 3/20 0.39
KDM4C Q9H3R0 2/20 0.39
KDM4A O75164 1/20 0.39
L3MBTL1 Q9Y468 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
SCHEMBL19681594 1.00 SIGMAR1 (0.83) SIGMAR1CYP1A2ALDH1A1TSHRPKM
SCHEMBL173002 1.00 SIGMAR1 (0.83) SIGMAR1CYP1A2ALDH1A1TSHRPKM
SCHEMBL10324648 0.98 SIGMAR1 (0.79) SIGMAR1CYP1A2ALDH1A1TSHRPKM
SCHEMBL10324713 0.93 SIGMAR1 (0.96) SIGMAR1CYP1A2ALDH1A1TSHRKDM5A
SCHEMBL10325527 0.93 SIGMAR1 (0.72) SIGMAR1CYP1A2ALDH1A1TSHRKDM5A
SCHEMBL10438441 0.91 SIGMAR1 (1.00) SIGMAR1CYP1A2ALDH1A1TSHRKDM5A
SCHEMBL10438376 0.91 SIGMAR1 (1.00) SIGMAR1CYP1A2ALDH1A1TSHRKDM5A
SCHEMBL10451607 0.91 SIGMAR1 (1.00) SIGMAR1CYP1A2ALDH1A1TSHRKDM5A
SCHEMBL10438445 0.91 SIGMAR1 (1.00) SIGMAR1CYP1A2ALDH1A1TSHRKDM5A
SCHEMBL10456237 0.91 SIGMAR1 (1.00) SIGMAR1CYP1A2ALDH1A1TSHRKDM5A

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-4024486-A1 ORGANIC PHOTOELECTRIC CONVERSION MATERIAL SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2022-07-06 EP disclosed