SCHEMBL31181925

SCHEMBL31181925

CCCCC(C)CCCCCCCC(C)CC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.50
LMNA P02545 2/20 0.46
DNM1 Q05193 2/20 0.43
OPRM1 P35372 1/20 0.42
SPHK1 Q9NYA1 1/20 0.39
PRKD3 O94806 1/20 0.39
PRKCG P05129 1/20 0.39
PRKCB P05771 1/20 0.39
PRKCA P17252 1/20 0.39
PRKCH P24723 1/20 0.39
PRKCI P41743 1/20 0.39
PRKCE Q02156 1/20 0.39
PRKCQ Q04759 1/20 0.39
PRKCZ Q05513 1/20 0.39
PRKCD Q05655 1/20 0.39
PRKD1 Q15139 1/20 0.39
ALDH1A1 P00352 3/20 0.39
TDP1 Q9NUW8 1/20 0.39
TSHR P16473 3/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL6064437 1.00 ACE2 (0.50) ACE2LMNADNM1OPRM1SPHK1
SCHEMBL6526315 1.00 ACE2 (0.50) ACE2LMNADNM1OPRM1SPHK1
SCHEMBL31509467 1.00 ACE2 (0.50) ACE2LMNADNM1OPRM1SPHK1
SCHEMBL6526318 1.00 ACE2 (0.50) ACE2LMNADNM1OPRM1SPHK1
SCHEMBL31521557 0.97 LMNA (0.48) ACE2LMNADNM1OPRM1SPHK1
SCHEMBL23673098 0.94 ACE2 (0.56) ACE2LMNADNM1OPRM1SPHK1
SCHEMBL5301387 0.94 ACE2 (0.56) ACE2LMNADNM1OPRM1SPHK1
SCHEMBL31134287 0.94 ACE2 (0.56) ACE2LMNADNM1OPRM1SPHK1
SCHEMBL5294632 0.94 ACE2 (0.56) ACE2LMNADNM1OPRM1SPHK1
SCHEMBL31509340 0.94 ACE2 (0.56) ACE2LMNADNM1OPRM1SPHK1

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
CN-118878395-A 1-Halo-2,6,14-trimethyloctadecane compound and process for preparing 5,13,17-trimethylalkane compound therefrom 信越化学工业株式会社 2024-11-01 CN disclosed