SCHEMBL14445889

SCHEMBL14445889

COc1cc(-c2nc(-c3ccc(N(C)C)cc3)c(-c3ccc(N(C)C)cc3)n2C)cc(OC)c1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB4A P04350 1/20 0.43
TUBB P07437 1/20 0.43
TUBA3C P0DPH7 1/20 0.43
TUBA1B P68363 1/20 0.43
TUBA4A P68366 1/20 0.43
TUBB4B P68371 1/20 0.43
TUBB3 Q13509 1/20 0.43
TUBB2A Q13885 1/20 0.43
TUBB8 Q3ZCM7 1/20 0.43
TUBA3E Q6PEY2 1/20 0.43
TUBA1A Q71U36 1/20 0.43
TUBA1C Q9BQE3 1/20 0.43
TUBB6 Q9BUF5 1/20 0.43
TUBB2B Q9BVA1 1/20 0.43
TUBB1 Q9H4B7 1/20 0.43
SMPD3 Q9NY59 4/20 0.42
MAPK14 Q16539 1/20 0.41
KDM4E B2RXH2 1/20 0.41
NPC1 O15118 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL9494004 0.87 SMPD3 (0.40) SMPD3KDM4ENPC1ALDH1A1LMNA
SCHEMBL14445896 0.86 SMPD3 (0.53) SMPD3MAPK14NOX1TEK
SCHEMBL13899814 0.85 NPC1 (0.45) MAPK14KDM4ENPC1ALDH1A1LMNA
SCHEMBL14446519 0.82 GABRG2 (0.38) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL10082740 0.80 SMPD3 (0.43) SMPD3TP53MAPTNOX1
SCHEMBL12152230 0.79 ALDH1A1 (0.47) MAPK14KDM4ENPC1ALDH1A1LMNA
SCHEMBL14446726 0.78 MAPK14 (0.42) MAPK14KDM4ENPC1ALDH1A1LMNA
SCHEMBL12152192 0.76 MAPK14 (0.41) MAPK14KDM4ENPC1ALDH1A1LMNA
SCHEMBL12152129 0.74 TEK (0.40) SMPD3KDM4EALDH1A1LMNATP53
SCHEMBL9425691 0.74 FAAH (0.46) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1684115-B1 Photothermographic material KONICA MINOLTA MED & GRAPHIC (JP) 2007-08-08 EP disclosed
US-20070054225-A1 SILVER SALT PHOTOTHERMOGRAPHIC DRY IMAGING MATERIAL KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2007-03-08 US disclosed
US-20070054225-A1 SILVER SALT PHOTOTHERMOGRAPHIC DRY IMAGING MATERIAL KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2007-03-08 US disclosed