SCHEMBL29093475

SCHEMBL29093475

CCc1cc2cc(OC(=O)c3ccccc3)ccc2[nH]1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PDGFRB P09619 12/20 0.62
▸ PDGFRA P16234 12/20 0.62
▸ KMT2A Q03164 4/20 0.56
▸ MEN1 O00255 2/20 0.56
▸ MAPT P10636 1/20 0.56
▸ TDP1 Q9NUW8 1/20 0.56
▸ CYP1A2 P05177 1/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ CYP2C9 P11712 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ HDAC6 Q9UBN7 1/20 0.49
▸ CA12 O43570 2/20 0.46
▸ CA9 Q16790 2/20 0.46
▸ FGFR1 P11362 1/20 0.45
▸ XDH P47989 1/20 0.45
▸ POLB P06746 1/20 0.44

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
SCHEMBL9512921 0.80 PDGFRB (0.78) PDGFRBPDGFRAKMT2AMEN1MAPT
SCHEMBL5272031 0.78 PDGFRB (0.51) PDGFRBPDGFRAKMT2AMEN1MAPT
SCHEMBL20629462 0.77 PDGFRB (0.63) PDGFRBPDGFRAKMT2AMEN1MAPT
SCHEMBL5268586 0.77 PDGFRB (0.53) PDGFRBPDGFRAKMT2AMEN1MAPT
SCHEMBL24553587 0.77 TSHR (0.60) PDGFRBPDGFRAKMT2AMEN1MAPT
SCHEMBL5268641 0.77 PDGFRB (0.52) PDGFRBPDGFRAKMT2AMEN1MAPT
SCHEMBL5270352 0.76 PDGFRB (0.51) PDGFRBPDGFRAKMT2AMEN1MAPT
SCHEMBL4905240 0.75 KMT2A (0.62) KMT2AMEN1MAPTTDP1
SCHEMBL25175574 0.75 MEN1 (0.64) PDGFRBPDGFRAKMT2AMEN1MAPT
SCHEMBL6256459 0.74 HRH3 (0.58) KMT2AMEN1TDP1

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
CN-111491918-B Aryl and heteroaryl substituted indole compounds 百时美施贵宝公司 2023-10-24 — — CN disclosed
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