Propanol

Propanol

SCHEMBL7990856

CCCO.O=C(OCCOCCOC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.71

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.71
▸ TDP1 Q9NUW8 4/20 0.59
▸ ALDH1A1 P00352 4/20 0.51
▸ ESR1 P03372 3/20 0.50
▸ TSHR P16473 3/20 0.50
▸ SLC6A2 P23975 2/20 0.50
▸ CHRM1 P11229 1/20 0.50
▸ KDR P35968 1/20 0.50
▸ MAPK1 P28482 3/20 0.49
▸ SCN5A Q14524 2/20 0.49
▸ ABCB11 O95342 1/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ ADRA2B P18089 1/20 0.49
▸ OPRD1 P41143 1/20 0.49
▸ PKM P14618 1/20 0.49
▸ ESR2 Q92731 1/20 0.49
▸ SLC6A3 Q01959 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ HIF1A Q16665 1/20 0.49
▸ CYP2D6 P10635 2/20 0.48

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
SCHEMBL22832552 0.91 LMNA (0.79) LMNATDP1ALDH1A1ESR1TSHR
SCHEMBL22832434 0.91 LMNA (0.79) LMNATDP1ALDH1A1ESR1TSHR
SCHEMBL1919741 0.91 LMNA (0.79) LMNATDP1ALDH1A1ESR1TSHR
SCHEMBL818564 0.89 TDP1 (0.63) LMNATDP1ALDH1A1ESR1TSHR
SCHEMBL2442856 0.89 TDP1 (0.63) LMNATDP1ALDH1A1ESR1TSHR
SCHEMBL9137591 0.89 TDP1 (0.63) LMNATDP1ALDH1A1ESR1TSHR
Octanol SCHEMBL28095113 0.89 LMNA (0.61) LMNATDP1ALDH1A1ESR1TSHR
SCHEMBL15512201 0.89 TDP1 (0.73) LMNATDP1ALDH1A1ESR1TSHR
SCHEMBL15512375 0.89 TDP1 (0.73) LMNATDP1ALDH1A1ESR1TSHR
SCHEMBL15512622 0.89 TDP1 (0.73) LMNATDP1ALDH1A1ESR1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1011609-A4 COMPOSITIONS FOR COSMETIC APPLICATIONS MEDLOGIC GLOBAL CORP (US) 2000-08-16 — — EP disclosed
EP-1011609-A1 COMPOSITIONS FOR COSMETIC APPLICATIONS MedLogic Global Corporation (US) 2000-06-28 — — EP disclosed
WO-1998050005-A1 COMPOSITIONS FOR COSMETIC APPLICATIONS MEDLOGIC GLOBAL CORPORATION (US) 1998-11-12 — — WO disclosed
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