SCHEMBL3243297

SCHEMBL3243297

COc1cc(-c2ccc(N3CCN(c4c(Cl)cncc4Cl)CC3)nc2)cc(OC)c1OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 6/20 0.47
TGFBR1 P36897 7/20 0.46
ACVR1 Q04771 7/20 0.46
ACVR1B P36896 2/20 0.46
ERN1 O75460 1/20 0.45
KCNH2 Q12809 2/20 0.45
PRKD3 O94806 1/20 0.44
EGFR P00533 1/20 0.44
PRKCG P05129 1/20 0.44
PRKCB P05771 1/20 0.44
LCK P06239 1/20 0.44
PRKCA P17252 1/20 0.44
PRKCH P24723 1/20 0.44
PRKCI P41743 1/20 0.44
PRKCE Q02156 1/20 0.44
PRKCQ Q04759 1/20 0.44
PRKCZ Q05513 1/20 0.44
PRKCD Q05655 1/20 0.44
PRKD1 Q15139 1/20 0.44
IL2 P60568 1/20 0.43

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
SCHEMBL5236345 0.88 ZAP70 (0.56) ZAP70TGFBR1ACVR1ACVR1BERN1
SCHEMBL5235053 0.84 ZAP70 (0.56) ZAP70TGFBR1ACVR1ACVR1BERN1
SCHEMBL5623507 0.80 ZAP70 (0.54) ZAP70TGFBR1ACVR1ACVR1BERN1
SCHEMBL5234898 0.79 ZAP70 (0.53) ZAP70TGFBR1ACVR1ACVR1BERN1
SCHEMBL5238872 0.78 ZAP70 (0.50) ZAP70ERN1IL2MAP4K1CNR2
SCHEMBL5238770 0.78 ERN1 (0.50) ZAP70ERN1IL2MAP4K1CNR2
SCHEMBL13136625 0.78 ZAP70 (0.52) ZAP70TGFBR1ACVR1ERN1PRKD3
SCHEMBL3243299 0.78 SMN1; SMN2 (0.49) ZAP70ACVR1ERN1KCNH2
SCHEMBL5232609 0.77 ZAP70 (0.55) ZAP70TGFBR1ACVR1ACVR1BERN1
SCHEMBL5232807 0.76 ERN1 (0.52) ZAP70TGFBR1ERN1PRKD3EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010057833-A1 COMPOUNDS FOR TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY BIOMARIN IGA, LTD. (BS) 2010-05-27 WO claimed
WO-2010057833-A1 COMPOUNDS FOR TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY BIOMARIN IGA, LTD. (BS) 2010-05-27 WO disclosed
WO-2010057833-A1 COMPOUNDS FOR TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY BIOMARIN IGA, LTD. (BS) 2010-05-27 WO disclosed