SCHEMBL14995543

SCHEMBL14995543

O=C(O)Oc1cc(-c2cc(F)cc(Cl)c2)n(-c2cccc(Cl)n2)n1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ RXRA P19793 8/20 0.37
▸ RXRB P28702 8/20 0.37
▸ RXRG P48443 8/20 0.37
▸ XPO1 O14980 1/20 0.35
▸ KMT2A Q03164 3/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ MARS1 P56192 2/20 0.33
▸ ATM Q13315 1/20 0.33
▸ MAPT P10636 1/20 0.32
▸ L3MBTL1 Q9Y468 2/20 0.32
▸ GAA P10253 1/20 0.32
▸ KDM5A P29375 1/20 0.32
▸ KDM4C Q9H3R0 1/20 0.32
▸ KDM5B Q9UGL1 1/20 0.32
▸ PPP1CA P62136 1/20 0.32
▸ PDE4A P27815 2/20 0.31
▸ PDE4B Q07343 2/20 0.31
▸ PDE4C Q08493 2/20 0.31
▸ PDE4D Q08499 2/20 0.31

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
SCHEMBL14995556 0.85 MARS1 (0.45) RXRARXRBRXRGXPO1KMT2A
SCHEMBL3432282 0.84 RXRA (0.52) RXRARXRBRXRGKMT2AMEN1
SCHEMBL15004267 0.84 KMT2A (0.50) KMT2AMEN1MARS1ATML3MBTL1
SCHEMBL14995435 0.79 RXRA (0.46) RXRARXRBRXRGKMT2AMEN1
SCHEMBL3428855 0.79 PPP1CA (0.50) RXRARXRBRXRGKMT2AMEN1
SCHEMBL14995646 0.79 RXRA (0.41) RXRARXRBRXRGKMT2AMEN1
SCHEMBL14995657 0.79 RXRA (0.43) RXRARXRBRXRGXPO1KMT2A
SCHEMBL14995389 0.78 RXRA (0.43) RXRARXRBRXRGKMT2AMEN1
SCHEMBL14995358 0.78 MARS1 (0.46) RXRARXRBRXRGKMT2AMEN1
SCHEMBL14995553 0.77 SLC5A1 (0.33) MARS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2785705-A1 CARBOXAMIDE-SUBSTITUTED HETEROARYL-PYRAZOLES AND THE USE THEREOF AiCuris GmbH & Co. KG (DE) 2014-10-08 — — EP disclosed
WO-2013079586-A1 CARBOXAMIDE-SUBSTITUTED HETEROARYL-PYRAZOLES AND THE USE THEREOF AICURIS GMBH & CO. KG (DE) 2013-06-06 — — WO disclosed
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