SCHEMBL21086289

SCHEMBL21086289

Oc1c2[nH]c3ccc(Cl)cc3c2cc2c1[nH]c1ccc(Cl)cc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 1/20 0.49
GRIN3B O60391 1/20 0.49
GRIN1 Q05586 1/20 0.49
GRIN2A Q12879 1/20 0.49
GRIN2B Q13224 1/20 0.49
GRIN2C Q14957 1/20 0.49
GRIN3A Q8TCU5 1/20 0.49
KDM4E B2RXH2 1/20 0.46
CHUK O15111 1/20 0.46
RXFP1 Q9HBX9 1/20 0.45
CA12 O43570 1/20 0.45
CA9 Q16790 1/20 0.45
PARP14 Q460N5 1/20 0.45
LMNA P02545 1/20 0.44
PTGS2 P35354 2/20 0.44
MEN1 O00255 2/20 0.44
MAPT P10636 2/20 0.44
KMT2A Q03164 2/20 0.44
ABCC4 O15439 1/20 0.44
C5 P01031 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
SCHEMBL17409102 0.83 ALDH1A1 (0.47) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL29538654 0.79 CHUK (0.52) CHUKRXFP1CA12CA9PARP14
SCHEMBL16433002 0.79 CHUK (0.52) CHUKRXFP1CA12CA9PARP14
SCHEMBL607827 0.79 CHUK (0.64) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL29453525 0.79 CHUK (0.64) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL29655425 0.78 CHUK (0.57) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL14292108 0.78 CHUK (0.57) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL17613793 0.77 ACHE (0.47) KDM4ECHUKMEN1MAPTKMT2A
SCHEMBL13640246 0.77 TUBB4A (0.48) KDM4ECHUKRXFP1LMNAMEN1
SCHEMBL29655447 0.76 CHUK (0.45) KDM4ECHUKRXFP1CA12CA9

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-2694057-B1 LIPOXYGENASE INHIBITORS STANFORD RES INST INT (US) 2019-06-05 EP disclosed