1,4-Butanediol

1,4-Butanediol

SCHEMBL16468151

O=S(=O)(O)OCCCCCCCCCCCCCCCCCO.OCCCCO

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FNTA P49354 2/20 0.47
FNTB P49356 2/20 0.47
CA1 P00915 15/20 0.44
CA2 P00918 15/20 0.44
CA9 Q16790 14/20 0.44
CA12 O43570 5/20 0.44
CA7 P43166 5/20 0.44
CA14 Q9ULX7 5/20 0.44
CA3 P07451 4/20 0.44
CA4 P22748 4/20 0.44
CA6 P23280 4/20 0.44
CA5A P35218 4/20 0.44
CA5B Q9Y2D0 4/20 0.44
TSHR P16473 2/20 0.40
KDM4E B2RXH2 1/20 0.40
USP2 O75604 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
MMP9 P14780 1/20 0.40
ALOX15 P16050 1/20 0.40

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
SCHEMBL211160 1.00 FNTA (0.47) FNTAFNTBCA1CA2CA9
SCHEMBL11587906 1.00 FNTA (0.47) FNTAFNTBCA1CA2CA9
SCHEMBL11399677 1.00 FNTA (0.47) FNTAFNTBCA1CA2CA9
SCHEMBL6049745 1.00 FNTA (0.47) FNTAFNTBCA1CA2CA9
SCHEMBL20275856 1.00 FNTA (0.47) FNTAFNTBCA1CA2CA9
Ammonia Solution, Strong SCHEMBL5665446 0.98 FNTA (0.46) FNTAFNTBCA1CA2CA9
SCHEMBL445778 0.97 FNTA (0.44) FNTAFNTBCA1CA2CA9
Ammonia Solution, Strong SCHEMBL11352454 0.95 FNTA (0.43) FNTAFNTBCA1CA2CA9
SCHEMBL710961 0.90
Ethylene Glycol SCHEMBL445777 0.90 FNTA (0.46) FNTAFNTBCA1CA2CA9

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
WO-2015088663-A1 METHOD FOR MAKING A TOPICAL COMPOSITION COMPRISING GROWTH FACTORS DERIVED FROM HUMAN UMBILICAL CORD BLOOD PLATELETS NOVO SOLUTIONS MD, LLC (US) 2015-06-18 WO disclosed
US-20150050331-A1 METHOD FOR MAKING A TOPICAL COMPOSITION COMPRISING GROWTH FACTORS DERIVED FROM HUMAN UMBILICAL CORD BLOOD PLATELETS NOVO SOLUTIONS MD, LLC (US) 2015-02-19 US disclosed