SCHEMBL21172015

SCHEMBL21172015

CC1(C)CCCCOC(=O)c2ccc(cc2)C(=O)OC(C)(C)CCCCOC(=O)c2ccc(cc2)C(=O)O1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.34
ALDH1A1 P00352 4/20 0.33
LMNA P02545 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
CES2 O00748 1/20 0.33
GMNN O75496 1/20 0.33
TDP2 O95551 1/20 0.33
TP53 P04637 1/20 0.33
CYP1A2 P05177 1/20 0.33
GLA P06280 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
MAPT P10636 1/20 0.33
HSPD1 P10809 1/20 0.33
THRB P10828 1/20 0.33
CYP2C9 P11712 1/20 0.33
NQO1 P15559 1/20 0.33

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
SCHEMBL21172016 0.98 IDO1 (0.33) IDO1ALDH1A1LMNASMN1; SMN2TDP1
SCHEMBL18609088 0.91 IDO1 (0.30) IDO1
SCHEMBL5586278 0.87 IDO1 (0.37) IDO1ALDH1A1LMNASMN1; SMN2TDP1
SCHEMBL36010 0.79 CA1 (0.42) ALDH1A1LMNAKDM4EMEN1TP53
Pharacine SCHEMBL3876076 0.79 CA1 (0.42) ALDH1A1LMNAKDM4EMEN1TP53
SCHEMBL28704246 0.79 CA1 (0.42) ALDH1A1LMNAKDM4EMEN1TP53
SCHEMBL3873588 0.79 CA1 (0.42) ALDH1A1LMNAKDM4EMEN1TP53
SCHEMBL28713686 0.79 CA1 (0.42) ALDH1A1LMNAKDM4EMEN1TP53
SCHEMBL2483184 0.77 CA1 (0.40) ALDH1A1LMNAMEN1TP53MAPT
SCHEMBL3174046 0.77 CA1 (0.40) ALDH1A1LMNAMEN1TP53MAPT

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-3141576-B1 FIBER-REINFORCED COMPOSITES MADE WITH MULTI-PART THERMOPLASTIC POLYMERS JOHNS MANVILLE (US) 2020-07-01 EP disclosed
US-20190217554-A1 FIBER-REINFORCED COMPOSITES MADE WITH MULTI-PART THERMOPLASTIC POLYMERS JOHNS MANVILLE 2019-07-18 US disclosed