SCHEMBL11312864

SCHEMBL11312864

Cc1cc(O)nc(O)c1-c1cccc2[nH]c(=O)nc(O)c12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MGAM O43451 4/20 0.34
▸ GAA P10253 4/20 0.34
▸ SI P14410 4/20 0.34
▸ MGAM2 Q2M2H8 4/20 0.34
▸ DAO P14920 2/20 0.34
▸ DDO Q99489 2/20 0.34
▸ PIM1 P11309 1/20 0.33
▸ PDE3B Q13370 1/20 0.33
▸ PDE3A Q14432 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CDK4 P11802 1/20 0.32
▸ CCND1 P24385 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ CHEK1 O14757 1/20 0.32
▸ WEE1 P30291 1/20 0.32
▸ CCNB2 O95067 1/20 0.32
▸ CDK1 P06493 1/20 0.32
▸ CCNB1 P14635 1/20 0.32

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
SCHEMBL28799116 0.77 CYP1A2 (0.45) MGAMGAASIMGAM2DAO
SCHEMBL4735747 0.71 IMPDH2 (0.47) GAADAODDOPDE3BPDE3A
SCHEMBL15846753 0.68 FEN1 (0.49) PIM1PDE3BPDE3ACDK4CCND1
SCHEMBL1620185 0.62 PARP1 (0.44) DAOPDE3BPDE3ACYP1A2KDM4E
Benzoylenurea SCHEMBL29947820 0.61 ALDH1A1 (0.58) GAADAODDOCYP1A2KDM4E
Benzoylenurea SCHEMBL357451 0.61 ALDH1A1 (0.58) GAADAODDOCYP1A2KDM4E
SCHEMBL1622939 0.59 IMPDH2 (0.44) GAADAODDOPDE3BPDE3A
SCHEMBL27958608 0.59 ADORA3 (0.37) KDM4EHPGDHSD17B10CHEK1PARP1
SCHEMBL14843284 0.59 PARP1 (0.49) MGAMGAASIMGAM2DAO
SCHEMBL9010781 0.59 KDM4E (0.59) MGAMPIM1PDE3BPDE3ACYP1A2

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
US-4284411-A CONDENSATION, PIGMENTING BAYER AKTIENGESELLSCHAFT (DE) 1981-08-18 — — US disclosed
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