1,6-Hexanediol

1,6-Hexanediol

SCHEMBL22977579

C=CC.C=CC.C=CC.OCCCCCCO

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.50
LMNA P02545 2/20 0.50
ALDH1A1 P00352 2/20 0.50
HSD17B10 Q99714 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.44
GPR84 Q9NQS5 1/20 0.36
FFAR1 O14842 1/20 0.36
FFAR4 Q5NUL3 1/20 0.36
KDM4E B2RXH2 1/20 0.35
MIF P14174 1/20 0.32
SQLE Q14534 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
Propene SCHEMBL28542606 1.00 TSHR (0.50) TSHRLMNAALDH1A1HSD17B10MEN1
1,6-Hexanediol SCHEMBL29249024 1.00 TSHR (0.50) TSHRLMNAALDH1A1HSD17B10MEN1
1,6-Hexanediol SCHEMBL21353993 1.00 TSHR (0.50) TSHRLMNAALDH1A1HSD17B10MEN1
1,6-Hexanediol SCHEMBL16178680 0.97 TSHR (0.47) TSHRLMNAALDH1A1HSD17B10MEN1
1,6-Hexanediol SCHEMBL16970400 0.97 TSHR (0.47) TSHRLMNAALDH1A1HSD17B10MEN1
1,4-Butanediol SCHEMBL565263 0.96 SMN1; SMN2 (0.47) TSHRLMNAALDH1A1HSD17B10MEN1
1,4-Butanediol SCHEMBL5903369 0.96
1,4-Butanediol SCHEMBL6334524 0.96 SMN1; SMN2 (0.47) TSHRLMNAALDH1A1HSD17B10MEN1
1,4-Butanediol SCHEMBL1425714 0.93 SMN1; SMN2 (0.44) TSHRLMNAALDH1A1HSD17B10MEN1
1,4-Butanediol SCHEMBL10941995 0.93 SMN1; SMN2 (0.44) TSHRLMNAALDH1A1HSD17B10MEN1

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-20210047843-A1 Scratch Resistant Coating AFI LICENSING LLC (US) 2021-02-18 US disclosed