SCHEMBL19879575

SCHEMBL19879575

COC(=O)C1(C)CCCC2(C)C3CC=C(C(C)C)C=C3CCC12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 1/20 0.52
▸ CYP3A4 P08684 3/20 0.48
▸ MAPT P10636 3/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ USP2 O75604 1/20 0.48
▸ TP53 P04637 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ HSD17B10 Q99714 3/20 0.43
▸ ALOX15 P16050 3/20 0.43
▸ PDK1 Q15118 2/20 0.43
▸ PDK2 Q15119 2/20 0.43
▸ PDK3 Q15120 2/20 0.43
▸ PDK4 Q16654 2/20 0.43
▸ CYP2C9 P11712 2/20 0.43
▸ CYP2C19 P33261 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ LMNA P02545 1/20 0.43
▸ SLCO1B3 Q9NPD5 1/20 0.43

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
SCHEMBL20067895 1.00 MMP2 (0.52) MMP2CYP3A4MAPTMEN1KMT2A
SCHEMBL152259 0.88 MMP2 (0.64) MMP2CYP3A4MAPTHSD17B10ALOX15
SCHEMBL2603445 0.88 MMP2 (0.64) MMP2CYP3A4MAPTHSD17B10ALOX15
SCHEMBL152258 0.88 MMP2 (0.64) MMP2CYP3A4MAPTHSD17B10ALOX15
SCHEMBL11029865 0.88 MMP2 (0.64) MMP2CYP3A4MAPTHSD17B10ALOX15
SCHEMBL20061643 0.88 MMP2 (0.64) MMP2CYP3A4MAPTHSD17B10ALOX15
SCHEMBL20061639 0.85 MMP2 (0.44) MMP2CYP3A4MAPTMEN1KMT2A
SCHEMBL15072082 0.84 MMP2 (0.43) MMP2CYP3A4MAPTMEN1KMT2A
SCHEMBL13459553 0.82 MMP2 (0.42) MMP2CYP3A4MAPTMEN1KMT2A
SCHEMBL17715030 0.81 MMP2 (0.40) MMP2CYP3A4MAPTMEN1KMT2A

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-9896537-B2 Norbornanyl rosin resin and process for preparing same YU HUI (US) 2018-02-20 — — US disclosed
US-9896537-B2 Norbornanyl rosin resin and process for preparing same YU HUI (US) 2018-02-20 — — US disclosed
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