SCHEMBL15435342

SCHEMBL15435342

CC(Br)c1ccc(C(C)(C)C)nc1

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 2/20 0.34

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
SCHEMBL1694606 0.83 CHRNA7 (0.38) IDH1
SCHEMBL1962579 0.82 SMN1; SMN2 (0.32)
SCHEMBL1789240 0.82 TRPV4 (0.48)
SCHEMBL24618209 0.82 IDH1 (0.34) IDH1
SCHEMBL25575002 0.80 IDH1 (0.34) IDH1
SCHEMBL14846920 0.80 PDE2A (0.40) IDH1
SCHEMBL2692329 0.80 PDE2A (0.40) IDH1
SCHEMBL12868052 0.80 UGT2B7 (0.34) IDH1
SCHEMBL21789264 0.80 IDH1 (0.34) IDH1
SCHEMBL12299466 0.78 PDE4A (0.34) IDH1

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-2687507-B1 NITROGEN-CONTAINING CONDENSED HETEROCYCLIC COMPOUND TAISHO PHARMACEUTICAL CO LTD (JP) 2016-03-09 EP disclosed
US-9035059-B2 Nitrogen-containing condensed heterocyclic compound TAISHO PHARMACEUTICAL CO., LTD. (JP) 2015-05-19 US disclosed
US-9035059-B2 Nitrogen-containing condensed heterocyclic compound TAISHO PHARMACEUTICAL CO., LTD. (JP) 2015-05-19 US disclosed
EP-2687507-A1 NITROGEN-CONTAINING CONDENSED HETEROCYCLIC COMPOUND Taisho Pharmaceutical Co., Ltd. (JP) 2014-01-22 EP disclosed