SCHEMBL10349467

SCHEMBL10349467

O=C1c2ccccc2-c2nn(OCc3ccccc3)c3cccc1c23

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EIF2AK2 P19525 2/20 0.56
▸ MAPK12 P53778 2/20 0.56
▸ MAPK13 O15264 1/20 0.56
▸ MAPK11 Q15759 1/20 0.56
▸ MAPK14 Q16539 1/20 0.56
▸ ALDH1A1 P00352 5/20 0.40
▸ TSHR P16473 2/20 0.40
▸ MAOB P27338 2/20 0.40
▸ LMNA P02545 3/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ POLB P06746 2/20 0.38
▸ APEX1 P27695 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ NPC1 O15118 2/20 0.38
▸ MAPT P10636 2/20 0.38
▸ CYP3A4 P08684 2/20 0.38
▸ PABPC1 P11940 2/20 0.38
▸ CASP1 P29466 2/20 0.38
▸ CASP7 P55210 2/20 0.38
▸ MAOA P21397 1/20 0.38

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
SCHEMBL10805604 0.80 MAPK14 (0.38) EIF2AK2MAPK12MAPK13MAPK11MAPK14
SCHEMBL11120339 0.72 EIF2AK2 (0.62) EIF2AK2MAPK12MAPK13MAPK11MAPK14
SCHEMBL30821077 0.72 EIF2AK2 (0.67) EIF2AK2MAPK12MAPK13MAPK11MAPK14
SCHEMBL8171875 0.72 EIF2AK2 (1.00) EIF2AK2MAPK12MAPK13MAPK11MAPK14
SCHEMBL8176664 0.71 EIF2AK2 (0.66) EIF2AK2MAPK12MAPK13MAPK11MAPK14
SCHEMBL8172006 0.67 EIF2AK2 (0.54) EIF2AK2MAPK12MAPK13MAPK11MAPK14
Anthraquinone SCHEMBL8469578 0.67 TSHR (0.68) ALDH1A1TSHRLMNAMEN1POLB
SCHEMBL9286184 0.66 EIF2AK2 (0.53) EIF2AK2MAPK12MAPK13MAPK11MAPK14
SCHEMBL4846358 0.66 EIF2AK2 (0.53) EIF2AK2MAPK12MAPK13MAPK11MAPK14
SCHEMBL6524461 0.62 KMT2A (0.74) ALDH1A1MEN1POLBKMT2AMAPT

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
EP-0203697-B1 A process for preparing substituted anthra[1,9-od]pyrazol-6(2H)-ones WARNER-LAMBERT COMPANY (US) 1990-06-13 — — EP disclosed
EP-0203697-A1 A process for preparing substituted anthra[1,9-od]pyrazol-6(2H)-ones WARNER-LAMBERT COMPANY (US) 1986-12-03 — — EP disclosed
US-4608439-A Process for preparing substituted anthra[1,9-cd]pyrazol-6(2H)-ones WARNER-LAMBERT COMPANY (US) 1986-08-26 — — US disclosed
US-4556654-A ANTICARCINOGENIC, FUNGICIDES, ANTISEPTICS WARNER-LAMBERT COMPANY (US) 1985-12-03 — — US disclosed
EP-0103381-A1 Substituted anthra(1,9-cd)pyrazol-6(2H)-ones WARNER-LAMBERT COMPANY (US) 1984-03-21 — — EP disclosed
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