SCHEMBL14822991

SCHEMBL14822991

Cc1ccccc1OCC(O)COCc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.62
▸ CYP1A2 P05177 2/20 0.62
▸ ALOX15 P16050 1/20 0.57
▸ CA1 P00915 3/20 0.55
▸ CA2 P00918 1/20 0.55
▸ CA7 P43166 1/20 0.55
▸ CA9 Q16790 1/20 0.55
▸ KMT2A Q03164 4/20 0.55
▸ MEN1 O00255 3/20 0.55
▸ LMNA P02545 3/20 0.55
▸ SMN1; SMN2 Q16637 1/20 0.55
▸ ADRB2 P07550 1/20 0.55
▸ ADRB1 P08588 1/20 0.55
▸ ADRB3 P13945 1/20 0.55
▸ SCN4A P35499 1/20 0.54
▸ MAPT P10636 2/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ CYP2D6 P10635 1/20 0.51
▸ CYP2C9 P11712 1/20 0.51
▸ HPGD P15428 1/20 0.51

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
SCHEMBL18423672 0.85 KDM4E (0.82) KDM4ECYP1A2ALOX15KMT2AMEN1
SCHEMBL14822990 0.83 KDM4E (0.68) KDM4ECYP1A2ALOX15KMT2AMEN1
SCHEMBL397022 0.82 CA1 (0.78) CYP1A2CA1CA2CA7CA9
SCHEMBL25443083 0.81 KDM4E (0.70) KDM4ECYP1A2ALOX15KMT2AMEN1
SCHEMBL13360648 0.80 CYP1A2 (0.69) KDM4ECYP1A2ALOX15KMT2AMEN1
SCHEMBL9662754 0.79 CA1 (0.64) KDM4ECYP1A2CA1CA2CA7
SCHEMBL300081 0.79 CA1 (0.64) KDM4ECYP1A2CA1CA2CA7
SCHEMBL19227378 0.79 CA1 (0.64) CYP1A2CA1CA2CA7CA9
SCHEMBL10599264 0.79 HTT (0.50) ADRB2ADRB1ADRB3
SCHEMBL9663864 0.79 CA1 (0.55) KDM4ECYP1A2CA1CA2CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8410210-B2 Fluorine-containing novolac resin, fluorine-containing surfactant, fluorine-containing surfactant composition, and resin composition DIC CORPORATION (JP) 2013-04-02 — — US disclosed
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