SCHEMBL10666583

SCHEMBL10666583

COCCOCCOC(=O)c1ccc(NN2CN(Nc3ccc(C(=O)OCCOCCOC)cc3)CN(Nc3ccc(C(=O)OCCOCCOC)cc3)C2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCB11 O95342 1/20 0.60
▸ CYP3A4 P08684 1/20 0.60
▸ ADRA2B P18089 1/20 0.60
▸ OPRD1 P41143 1/20 0.60
▸ SCN5A Q14524 1/20 0.60
▸ HPGD P15428 2/20 0.46
▸ MAPT P10636 4/20 0.43
▸ TSHR P16473 1/20 0.42
▸ RAB9A P51151 3/20 0.41
▸ RECQL P46063 2/20 0.41
▸ ALDH1A1 P00352 4/20 0.40
▸ MAPK1 P28482 2/20 0.40
▸ PKM P14618 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ SMN1; SMN2 Q16637 5/20 0.39
▸ HTR7 P34969 1/20 0.39
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ BLM P54132 1/20 0.39

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
SCHEMBL10670386 0.88 ABCB11 (0.45) ABCB11CYP3A4ADRA2BOPRD1SCN5A
SCHEMBL9928660 0.82 CYP3A4 (0.66) ABCB11CYP3A4ADRA2BOPRD1SCN5A
SCHEMBL10666828 0.80 HPGD (0.56) HPGDMAPTTSHRRAB9ARECQL
SCHEMBL10664774 0.78 MAPT (0.59) CYP3A4HPGDMAPTTSHRRAB9A
SCHEMBL10670435 0.78 MAPT (0.59) CYP3A4HPGDMAPTTSHRRAB9A
SCHEMBL10669998 0.78 MAPT (0.59) CYP3A4HPGDMAPTTSHRRAB9A
SCHEMBL9969969 0.77 TSHR (0.64) ABCB11CYP3A4ADRA2BOPRD1SCN5A
SCHEMBL16130571 0.76 CYP3A4 (0.59) ABCB11CYP3A4ADRA2BOPRD1SCN5A
SCHEMBL15430835 0.76 CYP3A4 (0.59) ABCB11CYP3A4ADRA2BOPRD1SCN5A
SCHEMBL9001430 0.76 ESR1 (0.64) ABCB11CYP3A4ADRA2BOPRD1SCN5A

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-4724137-A s-Triazine derivatives and their use as sun screen agents BASF AKTIENGESELLSCHAFT (DE) 1988-02-09 — — US disclosed
US-4617390-A SUNSCREEN AGENTS BASF AKTIENGESELLSCHAFT (DE) 1986-10-14 — — US disclosed
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