2-Pentanol

2-Pentanol

SCHEMBL29145290

C=CCOCC=C.CCCC(C)O

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA7 P43166 1/20 0.41
TDP1 Q9NUW8 2/20 0.37
HSD17B10 Q99714 1/20 0.37
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
KMT2A Q03164 1/20 0.36
CA9 Q16790 1/20 0.33
TSHR P16473 3/20 0.32
CYP3A4 P08684 1/20 0.31
MAPT P10636 1/20 0.31
CYP2C9 P11712 1/20 0.31

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
SCHEMBL631276 0.84 CA1 (0.42) CA1CA2CA7TDP1MEN1
1,3-Butanediol SCHEMBL5927899 0.83 CA1 (0.41) CA1CA2CA7TDP1MEN1
Isopropyl Alcohol SCHEMBL8520886 0.81 CA1 (0.50) CA1CA2CA7TDP1MEN1
SCHEMBL32668658 0.80
SCHEMBL32668764 0.80
SCHEMBL430122 0.80
Propylene Glycol SCHEMBL8520043 0.80 TDP1 (0.46) CA1CA2CA7TDP1HSD17B10
Propylene Glycol SCHEMBL278652 0.79 TDP1 (0.50) CA1CA2CA7TDP1HSD17B10
2-Pentanol SCHEMBL2029217 0.77 TSHR (0.57) HSD17B10TSHR
SCHEMBL475863 0.77 CA1 (0.48) CA1CA2CA7TDP1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117467398-B Printable OCA optical cement and preparation method thereof 广东鼎立森新材料有限公司 2024-07-05 CN disclosed
CN-117467398-A Printable OCA optical cement and preparation method thereof 广东鼎立森新材料有限公司 2024-01-30 CN disclosed