SCHEMBL8675620

SCHEMBL8675620

COc1c(Cc2ccccc2)cc2[nH]c(C)c(CC(C)O)c2c1Cl

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB4A P04350 5/20 0.36
TUBB P07437 5/20 0.36
TUBA3C P0DPH7 5/20 0.36
TUBA1B P68363 5/20 0.36
TUBA4A P68366 5/20 0.36
TUBB4B P68371 5/20 0.36
TUBB3 Q13509 5/20 0.36
TUBB2A Q13885 5/20 0.36
TUBB8 Q3ZCM7 5/20 0.36
TUBA3E Q6PEY2 5/20 0.36
TUBA1A Q71U36 5/20 0.36
TUBA1C Q9BQE3 5/20 0.36
TUBB6 Q9BUF5 5/20 0.36
TUBB2B Q9BVA1 5/20 0.36
TUBB1 Q9H4B7 5/20 0.36
PTPN5 P54829 1/20 0.33
HSP90AA1 P07900 4/20 0.33
CNR2 P34972 1/20 0.33
GPR55 Q9Y2T6 1/20 0.33
MDM4 O15151 1/20 0.32

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
SCHEMBL8645276 0.77 HSP90AA1 (0.33) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL8646870 0.76 HSP90AA1 (0.34) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL8661489 0.75 KRAS (0.31) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL8649727 0.75 KRAS (0.32) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL8642034 0.74 KRAS (0.32) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL8642543 0.74 HSP90AA1 (0.35) PTPN5HSP90AA1CNR2MAPTALDH1A1
SCHEMBL8645270 0.74 KRAS (0.30) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL8643258 0.73 KRAS (0.31) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL8642654 0.73 KRAS (0.31) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL8649362 0.72 ALDH1A1 (0.32) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5750558-A ANTIALLERGENS, ANTIINFLAMMATORY AGENTS ABBOTT LABORATORIES (US) 1998-05-12 US disclosed