SCHEMBL7257348

SCHEMBL7257348

CC1(C)CCCC(C)(C)N1[O].O=C(O)c1ccccc1CCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 3/20 0.52
SCN2A Q99250 3/20 0.52
SCN3A Q9NY46 3/20 0.52
ALDH1A1 P00352 7/20 0.46
TSHR P16473 3/20 0.46
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
ADRB2 P07550 1/20 0.45
FOLH1 Q04609 1/20 0.44
HTT P42858 1/20 0.44
LMNA P02545 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
KDM4E B2RXH2 1/20 0.43
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL7261115 0.85 SCN1A (0.41) SCN1ASCN2ASCN3AALDH1A1TSHR
SCHEMBL29975597 0.80 FOLH1 (0.66) SCN1ASCN2ASCN3AALDH1A1TSHR
SCHEMBL166927 0.80 FOLH1 (0.66) SCN1ASCN2ASCN3AALDH1A1TSHR
SCHEMBL8702953 0.78 FOLH1 (0.63) SCN1ASCN2ASCN3AALDH1A1TSHR
Hydrochloric Acid SCHEMBL7699238 0.78 FOLH1 (0.63) SCN1ASCN2ASCN3AALDH1A1TSHR
SCHEMBL27784696 0.76 FOLH1 (0.44) SCN1ASCN2ASCN3AALDH1A1TSHR
SCHEMBL8698803 0.74 FOLH1 (0.58) SCN1ASCN2ASCN3AALDH1A1TSHR
Benzoic Acid SCHEMBL17838773 0.74 TSHR (0.50) ALDH1A1TSHRKMT2AMEN1LMNA
SCHEMBL2512584 0.73 TP53 (0.43) SCN1ASCN2ASCN3AALDH1A1TSHR
SCHEMBL70392 0.72 FOLH1 (0.76) ALDH1A1TSHRADRB2FOLH1HTT

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-20020115793-A1 Methods of making telechelic oligomers, methods of making block copolymers, and novel block copolymers GAGNE MICHEL R (US) 2002-08-22 US claimed
US-6642322-B2 Reacting a substrate compound selected from polycarbonate, polyester, polyurethanes, polylactones with a chain transfer agent to form telechelic oligomers in presence of alkali metal catalyst; living free radical polymerization THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL 2003-11-04 US disclosed
US-20020115793-A1 Methods of making telechelic oligomers, methods of making block copolymers, and novel block copolymers GAGNE MICHEL R (US) 2002-08-22 US disclosed