SCHEMBL16253604

SCHEMBL16253604

C=C=Cc1cccc(CC)c1OC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 2/20 0.38
▸ CA2 P00918 2/20 0.38
▸ NFE2L2 Q16236 5/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ GABRA1 P14867 4/20 0.34
▸ GABRB2 P47870 4/20 0.34
▸ PRMT1 Q99873 1/20 0.33
▸ CYP24A1 Q07973 1/20 0.32
▸ CYP1A1 P04798 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP1B1 Q16678 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ TLR2 O60603 1/20 0.31
▸ ERN1 O75460 1/20 0.31
▸ TLR1 Q15399 1/20 0.31

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
SCHEMBL16253607 0.83 RIPK1 (0.34) CA1CA2NFE2L2MEN1ALDH1A1
SCHEMBL16253605 0.81 HTR1A (0.39) CA1CA2NFE2L2
SCHEMBL14999526 0.81 CA1 (0.41) CA1CA2NFE2L2MEN1ALDH1A1
SCHEMBL7102162 0.79 CA1 (0.59) CA1CA2NFE2L2MEN1ALDH1A1
SCHEMBL16253606 0.77 CA1 (0.37) CA1CA2NFE2L2ALDH1A1PRMT1
SCHEMBL16955328 0.77 CA1 (0.44) CA1CA2NFE2L2MEN1ALDH1A1
SCHEMBL16253609 0.76 CA1 (0.32) CA1CA2NFE2L2
SCHEMBL19123945 0.76 NFE2L2 (0.44) CA1CA2NFE2L2GABRA1GABRB2
SCHEMBL15427433 0.76 NFE2L2 (0.44) CA1CA2NFE2L2GABRA1GABRB2
SCHEMBL14999442 0.76 METAP2 (0.32) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170080409-A1 CATALYSTS FOR EPOXIDE CARBONYLATION NOVOMER, INC. (US) 2017-03-23 — — US disclosed
US-9359474-B2 Catalysts and methods for polymer synthesis NOVOMER, INC. (US) 2016-06-07 — — US disclosed
US-20140343246-A1 CATALYSTS AND METHODS FOR POLYMER SYNTHESIS SAUDI ARAMCO TECHNOLOGIES COMPANY (SA) 2014-11-20 — — US disclosed
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