SCHEMBL7739288

SCHEMBL7739288

CC1(C23CC4CC(CC(C4)C2)C3)CCCCC1.O=C(O)OC(=O)O

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.38
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.34
SCN1A P35498 1/20 0.33
SCN2A Q99250 1/20 0.33
SCN3A Q9NY46 1/20 0.33
HSD11B1 P28845 2/20 0.33
EPHX1 P07099 1/20 0.31
GLA P06280 1/20 0.31
THRB P10828 1/20 0.31
CYP2C9 P11712 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
Bicarbonate SCHEMBL7732891 0.89 ALDH1A1 (0.38) L3MBTL1ALDH1A1TSHRSCN1ASCN2A
Bicarbonate SCHEMBL7739293 0.89 ALDH1A1 (0.38) L3MBTL1ALDH1A1TSHRSCN1ASCN2A
SCHEMBL7732726 0.89 ALDH1A1 (0.35) L3MBTL1ALDH1A1TSHRSCN1ASCN2A
Bicarbonate SCHEMBL7732737 0.77 L3MBTL1 (0.36) L3MBTL1ALDH1A1TSHRSCN1ASCN2A
SCHEMBL9141081 0.72 GRIN2D (0.38) TSHRTHRB
SCHEMBL7733357 0.68 GLA (0.30) GLATHRBCYP2C9
Adamantane SCHEMBL3981831 0.67 HSD11B1 (0.40) L3MBTL1TSHRHSD11B1EPHX1THRB
SCHEMBL7732742 0.67 EPHX1 (0.32) ALDH1A1EPHX1
SCHEMBL4814394 0.65
SCHEMBL7739298 0.65 HSD11B1 (0.33) ALDH1A1HSD11B1EPHX1

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-6410748-B1 Alicycli c group-containing monomer KABUSHIKI KAISHA TOSHIBA (JP) 2002-06-25 US disclosed
US-6291129-B1 LIGHT SENSITIVE ELEMENT WITH UNSATURATED POLYMERS KABUSHIKI KAISHA TOSHIBA (JP) 2001-09-18 US disclosed