SCHEMBL15926425

SCHEMBL15926425

COc1ccc(-c2cc(C3=C(c4cc(-c5ccc(OC)cc5)sc4OC)C(F)(F)C(F)(F)C3(F)F)c(C)s2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 5/20 0.40
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
PGR P06401 1/20 0.38
ADRB2 P07550 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
MAOA P21397 1/20 0.38
TBXA2R P21731 1/20 0.38
SLC6A2 P23975 1/20 0.38
NPY1R P25929 1/20 0.38
ADORA2A P29274 1/20 0.38
ADORA1 P30542 1/20 0.38
AGTR1 P30556 1/20 0.38
CCKBR P32239 1/20 0.38
AVPR1A P37288 1/20 0.38
MC3R P41968 1/20 0.38
CHRNA4 P43681 1/20 0.38
SLC6A3 Q01959 1/20 0.38
KCNH2 Q12809 1/20 0.38
SLC29A1 Q99808 1/20 0.38

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
SCHEMBL2990966 0.94 APP (0.45) APPKMT2AMEN1PGRADRB2
SCHEMBL10101123 0.94 APP (0.45) APPKMT2AMEN1PGRADRB2
SCHEMBL20089651 0.90 APP (0.41) APPKMT2AMEN1PGRADRB2
SCHEMBL3361316 0.89 PLA2G10 (0.36) KMT2AMEN1IKBKBNPC1RAB9A
SCHEMBL9033357 0.86 GCGR (0.39) APPKMT2ANPC1RAB9AALDH1A1
SCHEMBL9034121 0.86 APP (0.41) APPKMT2AMEN1PGRADRB2
SCHEMBL13163334 0.84 APP (0.43) APPKMT2AMEN1IKBKBNPC1
SCHEMBL13164320 0.83 BACE1 (0.44) APPKMT2AMEN1IKBKBNPC1
SCHEMBL10104552 0.83 APP (0.36) APPKMT2AMEN1PGRADRB2
SCHEMBL3858306 0.82 APP (0.35) APPKMT2AMEN1PGRADRB2

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
EP-2159227-B1 Two-photon absorption material and application thereof RICOH CO LTD (JP) 2014-08-06 EP disclosed