Sugi Predict

Sugi Predict / Compounds / 1,4-Butanediol

1,4-Butanediol

1,4-Butanediol

SCHEMBL4370010

CCC(=COC=C(CC)CC)CC.OCCCCO

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ LMNA P02545 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ ACHE P22303 6/20 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
SCHEMBL4367813 0.97 LMNA (0.43) SMN1; SMN2LMNAALDH1A1HSD17B10MEN1
1,6-Hexanediol SCHEMBL4367823 0.97 LMNA (0.43) SMN1; SMN2LMNAALDH1A1HSD17B10MEN1
1,5-Pentanediol SCHEMBL4367822 0.97 LMNA (0.43) SMN1; SMN2LMNAALDH1A1HSD17B10MEN1
SCHEMBL4366491 0.97 LMNA (0.43) SMN1; SMN2LMNAALDH1A1HSD17B10MEN1
SCHEMBL540179 0.86 — —
1,4-Butanediol SCHEMBL4370220 0.84 SMN1; SMN2 (0.44) SMN1; SMN2LMNAALDH1A1HSD17B10MEN1
1,5-Pentanediol SCHEMBL4371571 0.83 LMNA (0.46) SMN1; SMN2LMNAALDH1A1HSD17B10MEN1
1,6-Hexanediol SCHEMBL4369163 0.83 LMNA (0.46) SMN1; SMN2LMNAALDH1A1HSD17B10MEN1
SCHEMBL4367819 0.83 LMNA (0.46) SMN1; SMN2LMNAALDH1A1HSD17B10MEN1
SCHEMBL4373352 0.83 LMNA (0.46) SMN1; SMN2LMNAALDH1A1HSD17B10MEN1

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-20090035696-A1 PHOTORESIST COMPOSITION KYOWA HAKKO CHEMICAL CO., LTD. (JP) 2009-02-05 — — US disclosed