Dodecanol

Dodecanol

SCHEMBL9297423

CCCCCC(C)(C)c1ccc(O)c(Sc2cc(C(C)(C)CCCCC)ccc2O)c1.CCCCCCCCCCCCO

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 18/20 0.54
▸ CNR2 P34972 17/20 0.54
▸ TSHR P16473 2/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ TP53 P04637 1/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ ALOX15 P16050 1/20 0.47
▸ NFKB1 P19838 1/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ THPO P40225 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ GMNN O75496 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ CYP2D6 P10635 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ APEX1 P27695 1/20 0.47

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
SCHEMBL11578857 0.94 CNR2 (0.57) CNR1CNR2
SCHEMBL51668 0.93 CNR2 (0.55) CNR1CNR2
SCHEMBL2059692 0.92 CNR2 (0.53) CNR1CNR2
SCHEMBL3825937 0.92 CNR2 (0.53) CNR1CNR2
Dodecanol SCHEMBL9297421 0.88 CYP3A4 (0.42) CNR1CNR2TSHRALDH1A1TP53
Ammonia Solution, Strong SCHEMBL4359375 0.87 CNR1 (0.47) CNR1CNR2TSHRALDH1A1TP53
Trolamine SCHEMBL9304476 0.87 CNR1 (0.47) CNR1CNR2TSHRALDH1A1TP53
Butylamine SCHEMBL10880274 0.86 CNR1 (0.51) CNR1CNR2
Butylamine SCHEMBL1532624 0.85 CNR1 (0.50) CNR1CNR2
SCHEMBL11686566 0.84 CNR2 (0.47) CNR1CNR2

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-5281570-A Heat sensitive sheets MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1994-01-25 — — US disclosed
Send feedback