SCHEMBL7192059

SCHEMBL7192059

COc1cc2cc(Br)c(C)cc2c(C)c1OC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB1 Q9H4B7 3/20 0.41
TUBB4A P04350 1/20 0.41
TUBB P07437 1/20 0.41
TUBA3C P0DPH7 1/20 0.41
TUBA1B P68363 1/20 0.41
TUBA4A P68366 1/20 0.41
TUBB4B P68371 1/20 0.41
TUBB3 Q13509 1/20 0.41
TUBB2A Q13885 1/20 0.41
TUBB8 Q3ZCM7 1/20 0.41
TUBA3E Q6PEY2 1/20 0.41
TUBA1A Q71U36 1/20 0.41
TUBA1C Q9BQE3 1/20 0.41
TUBB6 Q9BUF5 1/20 0.41
TUBB2B Q9BVA1 1/20 0.41
ACHE P22303 1/20 0.39
RAD52 P43351 1/20 0.38
MAPT P10636 4/20 0.36
TSHR P16473 3/20 0.36
MAOA P21397 2/20 0.36

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
SCHEMBL7200688 0.85 TUBB1 (0.45) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL8460294 0.81 AKR1B1 (0.39) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL7187364 0.79 ALOX5 (0.40) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL13063307 0.74 CYP19A1 (0.42) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL17807469 0.74 AXL (0.46) MAPTTSHRALDH1A1RXFP1NPSR1
SCHEMBL7196530 0.71 MAPT (0.47) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL27631190 0.71 ACHE (0.50) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL7194516 0.70 GPR55 (0.47) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL2633152 0.69 PTGES (0.49) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL1505362 0.68 MAPT (0.52) ACHEMAPTTSHRNPSR1POLB

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0980350-A4 HYDROXYNAPHTHOIC ACIDS AND DERIVATIVES UNIV NEW MEXICO (US) 2003-01-02 EP disclosed
US-6124498-A Hydroxynaphthoic acids and derivatives UNIVERSITY OF NEW MEXICO (US) 2000-09-26 US disclosed
EP-0980350-A2 HYDROXYNAPHTHOIC ACIDS AND DERIVATIVES The University of New Mexico (US) 2000-02-23 EP disclosed
WO-1998049130-A2 HYDROXYNAPHTHOIC ACIDS AND DERIVATIVES THE UNIVERSITY OF NEW MEXICO (US) 1998-11-05 WO disclosed