SCHEMBL4033843

SCHEMBL4033843

COc1cc(C=O)c(-c2ccc(Br)cc2)c(OC)c1OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 1/20 0.47
TUBB1 Q9H4B7 2/20 0.46
TUBB4A P04350 1/20 0.46
TUBB P07437 1/20 0.46
TUBA3C P0DPH7 1/20 0.46
TUBA1B P68363 1/20 0.46
TUBA4A P68366 1/20 0.46
TUBB4B P68371 1/20 0.46
TUBB3 Q13509 1/20 0.46
TUBB2A Q13885 1/20 0.46
TUBB8 Q3ZCM7 1/20 0.46
TUBA3E Q6PEY2 1/20 0.46
TUBA1A Q71U36 1/20 0.46
TUBA1C Q9BQE3 1/20 0.46
TUBB6 Q9BUF5 1/20 0.46
TUBB2B Q9BVA1 1/20 0.46
ERN1 O75460 6/20 0.44
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
TSHR P16473 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
SCHEMBL11763981 0.84 ERN1 (0.46) PRKDCTUBB1TUBB4ATUBBTUBA3C
SCHEMBL4038699 0.84 ERN1 (0.44) PRKDCERN1ALDH1A1KDM4ETSHR
SCHEMBL14427622 0.82 ERN1 (0.58) PRKDCTUBB1ERN1ALDH1A1KDM4E
SCHEMBL2743529 0.82 ALDH1A1 (0.57) PRKDCTUBB1ERN1ALDH1A1KDM4E
SCHEMBL15225838 0.75 ALDH1A1 (0.50) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL2743635 0.75 PRKDC (0.58) PRKDCERN1ALDH1A1KDM4ETSHR
SCHEMBL4599426 0.74 ERN1 (0.54) PRKDCERN1ALDH1A1KDM4ETSHR
SCHEMBL4039660 0.73 ERN1 (0.49) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL15225975 0.73 ERN1 (0.51) ERN1ALDH1A1KDM4ETDP1
SCHEMBL3751505 0.73 ALDH1A1 (0.59) PRKDCTUBB1ERN1ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2066632-B1 BENZOPHENONE DERIVATIVES USEFUL FOR INHIBITING FORMATION OF MICROTUBULE CHONG KUN DANG PHARM CORP (KR) 2013-09-04 EP disclosed
EP-2066632-A1 BENZOPHENONE DERIVATIVES USEFUL FOR INHIBITING FORMATION OF MICROTUBULE Chong Kun Dang Pharmaceutical Corp. (KR) 2009-06-10 EP disclosed
WO-2008038955-A1 BENZOPHENONE DERIVATIVES USEFUL FOR INHIBITING FORMATION OF MICROTUBULE CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2008-04-03 WO disclosed