SCHEMBL9136808

SCHEMBL9136808

CCOC(C)OCC.COc1cc(C=O)cc(OC)c1OC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB1 Q9H4B7 4/20 0.44
TUBB4A P04350 3/20 0.44
TUBB P07437 3/20 0.44
TUBA3C P0DPH7 3/20 0.44
TUBA1B P68363 3/20 0.44
TUBA4A P68366 3/20 0.44
TUBB4B P68371 3/20 0.44
TUBB3 Q13509 3/20 0.44
TUBB2A Q13885 3/20 0.44
TUBB8 Q3ZCM7 3/20 0.44
TUBA3E Q6PEY2 3/20 0.44
TUBA1A Q71U36 3/20 0.44
TUBA1C Q9BQE3 3/20 0.44
TUBB6 Q9BUF5 3/20 0.44
TUBB2B Q9BVA1 3/20 0.44
PDCD1 Q15116 1/20 0.44
CD274 Q9NZQ7 1/20 0.44
ALDH1A1 P00352 6/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43

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
SCHEMBL2743727 0.87 FDPS (0.47) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL24110817 0.84 ALDH1A1 (0.39) TUBB1TUBB4ATUBBTUBA3CTUBA1B
Ethylene SCHEMBL5783390 0.83 ALDH1A1 (0.40) ALDH1A1TSHRMAPK1KDM4EHTT
SCHEMBL9135687 0.83 ALDH1A1 (0.48) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL24110769 0.83 ALDH1A1 (0.38) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL96635 0.82 ALDH1A1 (0.59) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL16619850 0.82 ALDH1A1 (0.59) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL7457620 0.81 TUBB1 (0.55) TUBB1TUBB4ATUBBTUBA3CTUBA1B
Alcohol SCHEMBL28096074 0.81 ALDH1A1 (0.51) TUBB1TUBB4ATUBBTUBA3CTUBA1B
Hydrochloric Acid SCHEMBL23711567 0.80 ALDH1A1 (0.57) TUBB1TUBB4ATUBBTUBA3CTUBA1B

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
US-5393876-A Process for producing maltooligosaccharide derivatives WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 1995-02-28 US disclosed
EP-0566366-A2 Process for producing maltooligosaccharide derivative WAKO PURE CHEMICAL INDUSTRIES LTD (JP) 1993-10-20 EP disclosed