SCHEMBL22492979

SCHEMBL22492979

C/C=C/COC(=O)c1ccc(C(=O)OC/C=C/C)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.47
ESR1 P03372 3/20 0.47
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA7 P43166 1/20 0.47
CA9 Q16790 1/20 0.47
ESR2 Q92731 1/20 0.47
CA14 Q9ULX7 1/20 0.47
LMNA P02545 3/20 0.46
CYP1A2 P05177 2/20 0.46
CYP3A4 P08684 1/20 0.46
MAOA P21397 1/20 0.46
TSHR P16473 3/20 0.44
ALDH1A1 P00352 1/20 0.44
CHRM1 P11229 1/20 0.44
SLC6A2 P23975 1/20 0.44
KDR P35968 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
SNCA P37840 1/20 0.42

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
SCHEMBL1680326 1.00 TRPV1 (0.47) TRPV1ESR1CA12CA1CA2
SCHEMBL27370343 0.93 MAPT (0.50) TRPV1ESR1CA12CA1CA2
SCHEMBL2838297 0.91 KMT2A (0.49) TRPV1LMNAALDH1A1MEN1KMT2A
SCHEMBL27592817 0.91 HPGD (0.49) TRPV1LMNAALDH1A1MEN1KMT2A
SCHEMBL2838301 0.91 KMT2A (0.49) TRPV1LMNAALDH1A1MEN1KMT2A
SCHEMBL2434556 0.90 LMNA (0.55) LMNACYP1A2TSHRALDH1A1SLC6A2
SCHEMBL15450091 0.90 LMNA (0.55) LMNACYP1A2TSHRALDH1A1SLC6A2
SCHEMBL15869135 0.90 LMNA (0.55) LMNACYP1A2TSHRALDH1A1SLC6A2
SCHEMBL27844255 0.89 TSHR (0.45) TRPV1ESR1CA12CA1CA2
SCHEMBL12904284 0.84 THRB (0.48) TRPV1ESR1CA12CA1CA2

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-3718743-B1 A METHOD FOR MANUFACTURING COMPOSITE MATERIAL HAVING SELF-SUPPORTING CAPABILITY IN A MELT STATE THAT IS SUITABLE FOR FUSED GRANULATE FABRICATION AND A PRODUCT THEREOF UPM KYMMENE CORP (FI) 2021-06-02 EP disclosed
EP-3718743-A1 A METHOD FOR MANUFACTURING COMPOSITE MATERIAL HAVING SELF-SUPPORTING CAPABILITY IN A MELT STATE THAT IS SUITABLE FOR FUSED GRANULATE FABRICATION AND A PRODUCT THEREOF UPM-Kymmene Corporation (FI) 2020-10-07 EP disclosed