SCHEMBL8907914

SCHEMBL8907914

CCOC(=O)CCc1cccc(C2=C3C=CC(=N3)C(c3cccc(CCC(=O)OCC)c3)=C3C=CC(=N3)C(c3cccc(CCC(=O)OCC)c3)=C3C=CC(=N3)C(c3cccc(CCC(=O)OCC)c3)=C3C=CC2=N3)c1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 5/20 0.46
▸ CYP4F2 P78329 2/20 0.44
▸ CYP4A11 Q02928 2/20 0.44
▸ PDE3B Q13370 1/20 0.43
▸ PDE3A Q14432 1/20 0.43
▸ P2RY12 Q9H244 1/20 0.43
▸ PTPN1 P18031 1/20 0.40
▸ CYP4Z1 Q86W10 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.38
▸ FFAR1 O14842 1/20 0.38
▸ ABCB1 P08183 1/20 0.38
▸ PPARG P37231 1/20 0.38
▸ PPARA Q07869 1/20 0.38
▸ DGAT2 Q96PD7 1/20 0.38
▸ PPID Q08752 1/20 0.37
▸ MAPT P10636 1/20 0.37

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
SCHEMBL8903063 0.78 TDP1 (0.56) SYKCYP4F2CYP4A11PTPN1TDP1
SCHEMBL8907747 0.78 SLC7A5 (0.44) SYKCYP4F2CYP4A11PPARGPPARA
SCHEMBL4425984 0.77 CYP4F2 (0.64) SYKCYP4F2CYP4A11PDE3BPDE3A
SCHEMBL30540945 0.76 FFAR1 (0.55) SYKCYP4F2CYP4A11TDP1FFAR1
SCHEMBL21476713 0.76 FFAR1 (0.64) SYKCYP4F2CYP4A11FFAR1
SCHEMBL19718115 0.76 CYSLTR2 (0.47) PDE3BPDE3AP2RY12PPARGPPARA
SCHEMBL14018792 0.75 SMN1; SMN2 (0.55) SYKCYP4F2CYP4A11PDE3BPDE3A
SCHEMBL8043506 0.74 CYP4F2 (0.55) SYKCYP4F2CYP4A11PDE3BPDE3A
SCHEMBL21475923 0.74 HTR7 (0.57) SYKCYP4F2CYP4A11PTPN1TDP1
SCHEMBL13104077 0.73 CYP4F2 (0.58) SYKCYP4F2CYP4A11PDE3BPDE3A

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
EP-0684948-B1 MESO-TETRAPHENYL PORPHYRIN COMPLEX COMPOUNDS, PROCESS FOR PREPARING THE SAME AND PHARMACEUTICALS CONTAINING THE SAME DIAGNOSTIKFORSCHUNG INST (DE) 1997-10-22 — — EP disclosed
WO-1994019352-A1 MESO-TETRAPHENYL PORPHYRIN COMPLEX COMPOUNDS, PROCESS FOR PREPARING THE SAME AND PHARMACEUTICALS CONTAINING THE SAME Institut für Diagnostikforschung GmbH an der Freien Universität Berlin (DE) 1994-09-01 — — WO disclosed
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