SCHEMBL16206299

SCHEMBL16206299

CCN1C(C)(C)CC(OC(=O)CCC(=O)OC)CC1(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.42
NAAA Q02083 2/20 0.35
LMNA P02545 2/20 0.33
KDM4E B2RXH2 1/20 0.33
EPHX2 P34913 5/20 0.33
EPHX1 P07099 2/20 0.33
CA12 O43570 1/20 0.33
CA2 P00918 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
CA14 Q9ULX7 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
TP53 P04637 1/20 0.32

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
SCHEMBL2784910 0.95 NAAA (0.38) TSHRNAAASMN1; SMN2KMT2AALDH1A1
SCHEMBL2784913 0.89 NAAA (0.34) TSHRNAAALMNASMN1; SMN2KMT2A
SCHEMBL18680107 0.88 TSHR (0.39) TSHRNAAALMNAKDM4EEPHX2
SCHEMBL17267009 0.85 TSHR (0.33) TSHRNAAAKMT2AALDH1A1HTT
SCHEMBL4412312 0.83 TSHR (0.45) TSHRNAAALMNAKDM4EEPHX2
SCHEMBL25599800 0.81 NAAA (0.43) TSHRNAAAEPHX2SMN1; SMN2ALDH1A1
SCHEMBL12244965 0.81 EPHX2 (0.36) TSHRNAAAKDM4EEPHX2SMN1; SMN2
SCHEMBL8811351 0.80 KMT2A (0.47) TSHRKMT2AALDH1A1HTTHSD17B10
SCHEMBL210915 0.79 SMN1; SMN2 (0.36) TSHRNAAASMN1; SMN2KMT2AALDH1A1
SCHEMBL7476147 0.78 TSHR (0.39) TSHRNAAASMN1; SMN2KMT2AALDH1A1

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-20230366128-A1 UHMWPE FIBER AVIENT PROTECTIVE MAT B V (NL) 2023-11-16 US disclosed
US-20160108556-A1 UHMWPE FIBER DSMP IP ASSETS B.V. (NL) 2016-04-21 US disclosed
US-20140322516-A1 POLYOLEFIN FIBER DSM IP ASSETS B.V. (NL) 2014-10-30 US disclosed