SCHEMBL9698969

SCHEMBL9698969

O=C(O)c1cccc(CC(Br)(Br)Br)c1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 4/20 0.61
MRGPRX4 Q96LA9 3/20 0.51
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50
HIF1A Q16665 1/20 0.50
ANPEP P15144 1/20 0.50
ENPEP Q07075 1/20 0.50
MEP1B Q16820 1/20 0.49
KMT2A Q03164 1/20 0.49
NR4A2 P43354 1/20 0.49
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA6 P23280 1/20 0.48
CA9 Q16790 1/20 0.48
ALDH1A1 P00352 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48

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
SCHEMBL31506361 0.83 FOLH1 (0.59) FOLH1MRGPRX4CYP2D6CYP2C9HIF1A
SCHEMBL849483 0.83 FOLH1 (0.59) FOLH1MRGPRX4CYP2D6CYP2C9HIF1A
SCHEMBL1690483 0.83 FOLH1 (0.59) FOLH1MRGPRX4CYP2D6CYP2C9HIF1A
SCHEMBL5489257 0.82 MEP1B (0.50) FOLH1MRGPRX4MEP1BALDH1A1
SCHEMBL1313676 0.81 FOLH1 (0.58) FOLH1MRGPRX4CYP2D6CYP2C9HIF1A
SCHEMBL14478253 0.80 FOLH1 (0.56) FOLH1MRGPRX4CYP2D6CYP2C9HIF1A
SCHEMBL4642854 0.80 FOLH1 (0.56) FOLH1MRGPRX4CYP2D6CYP2C9HIF1A
SCHEMBL4640475 0.80 FOLH1 (0.56) FOLH1MRGPRX4CYP2D6CYP2C9HIF1A
SCHEMBL40393 0.80 FOLH1 (0.66) FOLH1MRGPRX4CYP2D6CYP2C9HIF1A
SCHEMBL29964040 0.80 FOLH1 (0.66) FOLH1MRGPRX4CYP2D6CYP2C9HIF1A

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-0507576-A1 Polypropylene-based resin compositions TOSOH CORPORATION (JP) 1992-10-07 EP disclosed