SCHEMBL8387609

SCHEMBL8387609

BrCC=Cc1ncn(C(c2ccccc2)(c2ccccc2)c2ccccc2)n1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32

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
SCHEMBL8387605 1.00 CYP11B1 (0.32) CYP11B1CYP11B2
SCHEMBL8386882 0.85 CYP11B1 (0.32) CYP11B1CYP11B2
SCHEMBL8386884 0.85 CYP11B1 (0.32) CYP11B1CYP11B2
SCHEMBL8386856 0.85 CYP11B1 (0.32) CYP11B1CYP11B2
SCHEMBL8386858 0.85 CYP11B1 (0.32) CYP11B1CYP11B2
SCHEMBL8387811 0.78 TRPA1 (0.38) CYP11B1CYP11B2
SCHEMBL8387805 0.78 TRPA1 (0.38) CYP11B1CYP11B2
SCHEMBL8385599 0.77 CYP11B1 (0.30) CYP11B1CYP11B2
SCHEMBL8385600 0.77 CYP11B1 (0.30) CYP11B1CYP11B2
SCHEMBL21293618 0.77 HCAR2 (0.40)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5922644-A POSTEMERGENCE HERBICIDES EFFECTIVE AGAINST A BROAD RANGE OF WEED SPECIES; MAY BE USED AS SELECTIVE HERBICIDES IN SOYA, SUGAR BEET, AND OIL-SEED RAPE CROPS ZENECA LIMITED (GB) 1999-07-13 US disclosed
EP-0625873-B1 PHOSPHONIC ACID DERIVATIVES CONTAINING A TRIAZOLE RING AS HERBICIDES ZENECA LTD (GB) 1997-11-05 EP disclosed
US-5393732-A Triazole phosphoric acid derivatives and their use as herbicides ZENECA LIMITED (GB) 1995-02-28 US disclosed
EP-0625873-A1 PHOSPHONIC ACID DERIVATIVES CONTAINING A TRIAZOLE RING AS HERBICIDES ZENECA LIMITED (GB) 1994-11-30 EP disclosed
WO-1993015610-A1 PHOSPHONIC ACID DERIVATIVES CONTAINING A TRIAZOLE RING AS HERBICIDES ZENECA LIMITED (GB) 1993-08-19 WO disclosed