SCHEMBL10333403

SCHEMBL10333403

COc1cc2cc3c(N)n[nH]c3nc2cc1OC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 2/20 0.51
▸ PDE3A Q14432 2/20 0.51
▸ KDM4E B2RXH2 6/20 0.48
▸ ALDH1A1 P00352 5/20 0.48
▸ HPGD P15428 3/20 0.48
▸ GLA P06280 2/20 0.48
▸ GAA P10253 2/20 0.48
▸ SRC P12931 1/20 0.44
▸ SLC2A1 P11166 2/20 0.43
▸ MAPT P10636 4/20 0.42
▸ TP53 P04637 3/20 0.42
▸ LMNA P02545 2/20 0.42
▸ HSD17B10 Q99714 2/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ CASP1 P29466 1/20 0.42
▸ CASP7 P55210 1/20 0.42
▸ POLB P06746 3/20 0.41
▸ SMARCA2 P51531 1/20 0.41
▸ KMT2A Q03164 1/20 0.41

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
SCHEMBL2090637 0.78 NCF1 (0.47) PDE3BPDE3AKDM4EALDH1A1HPGD
SCHEMBL10333750 0.78 PDE3B (0.54) PDE3BPDE3AKDM4EALDH1A1LMNA
SCHEMBL25366182 0.78 GAA (0.58) PDE3BPDE3AKDM4EALDH1A1HPGD
SCHEMBL30588978 0.78 GAA (0.58) PDE3BPDE3AKDM4EALDH1A1HPGD
SCHEMBL10333544 0.77 PDE3B (0.57) PDE3BPDE3AKDM4EALDH1A1HPGD
SCHEMBL17942820 0.70 ALDH1A1 (0.50) PDE3BPDE3AKDM4EALDH1A1HPGD
SCHEMBL9755422 0.70 NQO2 (0.60) PDE3BPDE3AKDM4EALDH1A1HPGD
SCHEMBL10333619 0.69 GAA (0.57) PDE3BPDE3AKDM4EALDH1A1HPGD
SCHEMBL10334229 0.69 PDE3B (0.50) PDE3BPDE3AKDM4EALDH1A1HPGD
SCHEMBL12467975 0.69 PDPK1 (0.34) KDM4EALDH1A1HPGDHSD17B10TSHR

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
US-4920128-A TREATMENT OF HERPES VIRUS STERLING DRUG INC. (US) 1990-04-24 — — US claimed
US-4920128-A TREATMENT OF HERPES VIRUS STERLING DRUG INC. (US) 1990-04-24 — — US disclosed
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