SCHEMBL2957519

SCHEMBL2957519

BrC/C=C/c1ccccc1.[PbH2]

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.50
PAM P19021 1/20 0.50
MAOB P27338 2/20 0.48
HTR2A P28223 3/20 0.47
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
SIGMAR1 Q99720 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KDM4E B2RXH2 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
SCHEMBL625625 0.97 IDO1 (0.52) IDO1PAMMAOBHTR2AMEN1
SCHEMBL1919743 0.97 IDO1 (0.52) IDO1PAMMAOBHTR2AMEN1
SCHEMBL250822 0.97 IDO1 (0.52) IDO1PAMMAOBHTR2AMEN1
SCHEMBL11024500 0.95 IDO1 (0.50) IDO1PAMMAOBHTR2AMEN1
SCHEMBL11739996 0.95 IDO1 (0.50) IDO1PAMMAOBHTR2AMEN1
SCHEMBL2957520 0.95 IDO1 (0.50) IDO1PAMMAOBHTR2AMEN1
SCHEMBL11024503 0.95 IDO1 (0.50) IDO1PAMMAOBHTR2AMEN1
Propene SCHEMBL2405130 0.87 HTR2A (0.46) IDO1PAMMAOBHTR2AMEN1
SCHEMBL10880315 0.87 IDO1 (0.44) IDO1PAMMAOBHTR2AMEN1
Propene SCHEMBL2405128 0.87 HTR2A (0.46) IDO1PAMMAOBHTR2AMEN1

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
US-7763741-B2 Separation of ginkgolides and bilobalide from G. biloba THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2010-07-27 US disclosed
US-20080108837-A1 Separation Of Ginkgolides And Bilobalide From G. Biloba THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2008-05-08 US disclosed
WO-2005046829-A2 SEPARATION OF GINKGOLIDES AND BILOBALIDE FROM G. BILOBA THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2005-05-26 WO disclosed