SCHEMBL8330504

SCHEMBL8330504

CCOC(=O)C(OCCCc1cc(OC)c(OC)c(OC)c1)C(=O)OCC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNKS2 Q9H2K2 1/20 0.45
KMT2A Q03164 4/20 0.45
ALDH1A1 P00352 3/20 0.45
TUBB4A P04350 2/20 0.45
TUBB P07437 2/20 0.45
TUBA3C P0DPH7 2/20 0.45
TUBA1B P68363 2/20 0.45
TUBA4A P68366 2/20 0.45
TUBB4B P68371 2/20 0.45
TUBB3 Q13509 2/20 0.45
TUBB2A Q13885 2/20 0.45
TUBB8 Q3ZCM7 2/20 0.45
TUBA3E Q6PEY2 2/20 0.45
TUBA1A Q71U36 2/20 0.45
TUBA1C Q9BQE3 2/20 0.45
TUBB6 Q9BUF5 2/20 0.45
TUBB2B Q9BVA1 2/20 0.45
TUBB1 Q9H4B7 2/20 0.45
KDM4E B2RXH2 1/20 0.45
MEN1 O00255 1/20 0.45

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
SCHEMBL8330509 0.94 TNKS2 (0.42) TNKS2KMT2AALDH1A1TUBB4ATUBB
SCHEMBL8332678 0.92 ALDH1A1 (0.47) KMT2AALDH1A1TUBB4ATUBBTUBA3C
SCHEMBL8332681 0.85 KMT2A (0.44) KMT2AALDH1A1TUBB4ATUBBTUBA3C
SCHEMBL8330517 0.81 ALDH1A1 (0.48) KMT2AALDH1A1TUBB4ATUBBTUBA3C
SCHEMBL8330920 0.76 LMNA (0.53) KDM4EMAPT
SCHEMBL6774946 0.74 LPAR1 (0.49) KMT2AALDH1A1TUBB4ATUBBTUBA3C
SCHEMBL491077 0.74 ALDH1A1 (0.62) KMT2AALDH1A1KDM4EMEN1GAA
SCHEMBL490351 0.74 KMT2A (0.51) KMT2AALDH1A1KDM4EMEN1GAA
SCHEMBL8233587 0.73 TUBB4A (0.57) TNKS2TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL7424861 0.72 HTR2A (0.69) TUBB4ATUBBTUBA3CTUBA1BTUBA4A

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-5908863-A ANTIGROWTH AGENT FOR BONES DOMPE' S.P.A. (IT) 1999-06-01 US disclosed
EP-0792878-A2 Geminal carboxylic acids and esters thereof, pharmaceutical formulations containing them useful in the treatment of bone dysmetabolism Dompé S.P.A. (IT) 1997-09-03 EP disclosed