SCHEMBL7263206

SCHEMBL7263206

COc1ccc(Oc2ccnc(F)c2F)cc1Br

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PDGFRA P16234 4/20 0.47
▸ PDGFRB P09619 1/20 0.47
▸ EGFR P00533 2/20 0.42
▸ KDR P35968 3/20 0.40
▸ TRPA1 O75762 2/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.37
▸ FGFR2 P21802 3/20 0.36
▸ KIT P10721 1/20 0.36
▸ AXL P30530 1/20 0.36
▸ POLB P06746 1/20 0.36

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
SCHEMBL7258836 0.82 KDM4E (0.52) PDGFRAPDGFRBKDRALDH1A1FGFR2
SCHEMBL7263203 0.82 PDGFRA (0.50) PDGFRAPDGFRBEGFRKDRALDH1A1
SCHEMBL7263674 0.82 THRB (0.44) PDGFRAPDGFRBCYP2D6FGFR2
SCHEMBL7258379 0.81 FGFR2 (0.44) PDGFRAPDGFRBKDRTRPA1CYP1A2
SCHEMBL7258432 0.81 TUBB1 (0.46) PDGFRAPDGFRBKDRCYP1A2CYP2C9
SCHEMBL7262694 0.72 LMNA (0.58) CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL6692393 0.71 THRB (0.39) EGFRKDRALDH1A1POLB
SCHEMBL30851753 0.70 HPGD (0.40) PDGFRAPDGFRBEGFRTRPA1CYP1A2
SCHEMBL29634588 0.69 CA12 (0.65) CYP1A2CYP3A4CYP2D6CYP2C19ALDH1A1
SCHEMBL258418 0.69 CA12 (0.65) CYP1A2CYP3A4CYP2D6CYP2C19ALDH1A1

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
WO-2003094845-A2 PYRIDINE-BASED THYROID RECEPTOR LIGANDS BRISTOL-MYERS SQUIBB COMPANY (US) 2003-11-20 — — WO disclosed
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