SCHEMBL10982120

SCHEMBL10982120

CCCCc1cc(CP(=O)(OC)OC)cc(CCCC)c1O

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 5/20 0.42
▸ PTGS2 P35354 5/20 0.41
▸ EGFR P00533 1/20 0.38
▸ TYR P14679 1/20 0.37
▸ MAOA P21397 1/20 0.36
▸ NPC1 O15118 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ ENPP2 Q13822 1/20 0.34
▸ ELANE P08246 1/20 0.33
▸ CTSG P08311 1/20 0.33
▸ TRPV1 Q8NER1 1/20 0.33
▸ HCAR3 P49019 1/20 0.33
▸ HCAR2 Q8TDS4 1/20 0.33
▸ TSHR P16473 1/20 0.33

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
SCHEMBL13013083 0.86 ALOX5 (0.41) ALOX5PTGS2EGFRTYRMAOA
SCHEMBL191427 0.86 EGFR (0.38) ALOX5PTGS2EGFRTYRMAOA
SCHEMBL4816988 0.82 LPAR3 (0.42) ALOX5PTGS2ENPP2
SCHEMBL9502006 0.82 ENPP2 (0.51) ALOX5PTGS2EGFRTYRMAOA
SCHEMBL10039964 0.80 ALOX5 (0.38) ALOX5PTGS2EGFRTYRMAOA
SCHEMBL28177157 0.78 HMGCR (0.38) ALOX5PTGS2EGFRTYRMAOA
SCHEMBL7157597 0.78 CYP3A4 (0.37) ALOX5PTGS2EGFR
SCHEMBL9818278 0.77 TYR (0.36) ALOX5PTGS2EGFRTYRMAOA
SCHEMBL11690877 0.76 ESR1 (0.42) ALOX5PTGS2TYRMAOA
SCHEMBL201692 0.75 NPC1 (0.57) ALOX5PTGS2EGFRTYRNPC1

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-4515768-A STABILIZER AGAINST THERMAL DECOMPOSITION AIRWICK INDUSTRIES, INC. (US) 1985-05-07 — — US disclosed
EP-0036385-B1 INSECTICIDAL VAPOUR-EMITTING COMPOSITIONS ON THE BASIS OF PYRETHRINOIDS Airwick AG (CH) 1984-05-02 — — EP disclosed
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