Dodecanol

Dodecanol

SCHEMBL28520384

CC(C(=O)O)N(C)C.CCCCCCCCCCCCO

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.50
ALDH1A1 P00352 3/20 0.50
LMNA P02545 2/20 0.50
HSD17B10 Q99714 2/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.46
ACE2 Q9BYF1 1/20 0.43
GPR84 Q9NQS5 7/20 0.42
FFAR1 O14842 2/20 0.42
PPARD Q03181 7/20 0.41
MAPT P10636 1/20 0.41
LCK P06239 1/20 0.41
ZDHHC20 Q5W0Z9 1/20 0.41
ZDHHC2 Q9UIJ5 1/20 0.41
PPARG P37231 6/20 0.39
PPARA Q07869 6/20 0.39
HDAC11 Q96DB2 5/20 0.39
TLR2 O60603 2/20 0.39
TDP1 Q9NUW8 2/20 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
Decanol SCHEMBL27846465 1.00 TSHR (0.50) TSHRALDH1A1LMNAHSD17B10MEN1
SCHEMBL28025488 0.92 ACE2 (0.48) TSHRALDH1A1HSD17B10MEN1KMT2A
Dodecane SCHEMBL27603441 0.92 ACE2 (0.48) TSHRALDH1A1HSD17B10MEN1KMT2A
Dymanthine SCHEMBL27739153 0.83 DNM1 (0.56) TSHRALDH1A1ACE2GPR84FFAR1
Behenic Acid SCHEMBL27639629 0.83 GPR84 (0.63) TSHRALDH1A1LMNAHSD17B10MEN1
SCHEMBL28775739 0.83 DNM1 (0.56) TSHRALDH1A1ACE2GPR84FFAR1
Octadecylamine SCHEMBL28778463 0.83 DNM1 (0.48) TSHRALDH1A1MEN1KMT2AACE2
Dodecylamine SCHEMBL27915642 0.83 DNM1 (0.48) TSHRALDH1A1MEN1KMT2AACE2
Tridecanoate SCHEMBL27985898 0.83 GPR84 (0.63) TSHRALDH1A1LMNAHSD17B10MEN1
Nonadecanoic Acid SCHEMBL28060963 0.83 GPR84 (0.63) TSHRALDH1A1LMNAHSD17B10MEN1

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-112165949-A Topical therapy using taxane nanoparticles for the treatment of Cervical Intraepithelial Neoplasia (CIN) and cervical cancer DFB索里亚有限责任公司 2021-01-01 CN disclosed