SCHEMBL9626269

SCHEMBL9626269

COc1cccc(C2=NN(c3ccccc3)C(c3ccccc3)C2)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 4/20 0.71
▸ MAOA P21397 1/20 0.65
▸ MAOB P27338 1/20 0.65
▸ MEN1 O00255 5/20 0.63
▸ KMT2A Q03164 5/20 0.63
▸ KDM4E B2RXH2 3/20 0.63
▸ ALDH1A1 P00352 3/20 0.63
▸ MAPT P10636 3/20 0.63
▸ LMNA P02545 1/20 0.63
▸ EGFR P00533 2/20 0.62
▸ ERBB2 P04626 2/20 0.62
▸ MMP2 P08253 1/20 0.61
▸ MMP9 P14780 1/20 0.61
▸ ATM Q13315 5/20 0.61
▸ L3MBTL1 Q9Y468 4/20 0.61
▸ RAB9A P51151 1/20 0.61
▸ USP2 O75604 1/20 0.60
▸ TDP1 Q9NUW8 1/20 0.60
▸ GLA P06280 2/20 0.57
▸ GAA P10253 2/20 0.57

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
SCHEMBL15301042 0.85 MEN1 (0.83) PDE5AMEN1KMT2AKDM4EALDH1A1
SCHEMBL8171663 0.85 MEN1 (0.83) PDE5AMEN1KMT2AKDM4EALDH1A1
SCHEMBL9514571 0.85 MEN1 (0.78) PDE5AMAOAMAOBMEN1KMT2A
SCHEMBL12496095 0.83 PDE5A (1.00) PDE5AMEN1KMT2AKDM4EALDH1A1
SCHEMBL10362296 0.83 EGFR (0.81) PDE5AMEN1KMT2AKDM4EALDH1A1
SCHEMBL15301347 0.83 MEN1 (0.82) PDE5AMEN1KMT2AKDM4EALDH1A1
SCHEMBL15301136 0.83 KDM4E (0.88) PDE5AMEN1KMT2AKDM4EALDH1A1
SCHEMBL23052404 0.82 MEN1 (0.73) MAOAMAOBMEN1KMT2AKDM4E
SCHEMBL395608 0.82 MEN1 (0.73) MAOAMAOBMEN1KMT2AKDM4E
SCHEMBL21531879 0.80 L3MBTL1 (0.64) MAOAMAOBMEN1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0201725-B1 ELECTROPHOTOGRAPHIC REGISTRATION MATERIAL HOECHST AKTIENGESELLSCHAFT (DE) 1992-03-18 — — EP claimed
US-4681827-A OXAZOLE, OXADIAZOLE, HYDRAZONE OR PYRAZOLINE; PHOTOCONDUCTIVITY; RECORDING HOECHST AKTIENGESELLSCHAFT (DE) 1987-07-21 — — US claimed
EP-0201725-A2 Electrophotographic registration material HOECHST AKTIENGESELLSCHAFT (DE) 1986-11-20 — — EP claimed
EP-0201725-B1 ELECTROPHOTOGRAPHIC REGISTRATION MATERIAL HOECHST AKTIENGESELLSCHAFT (DE) 1992-03-18 — — EP disclosed
US-4681827-A OXAZOLE, OXADIAZOLE, HYDRAZONE OR PYRAZOLINE; PHOTOCONDUCTIVITY; RECORDING HOECHST AKTIENGESELLSCHAFT (DE) 1987-07-21 — — US disclosed
EP-0201725-A2 Electrophotographic registration material HOECHST AKTIENGESELLSCHAFT (DE) 1986-11-20 — — EP disclosed
Send feedback