SCHEMBL7936965

SCHEMBL7936965

C=C(C(=O)OCCCCCC)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.56
LMNA P02545 3/20 0.55
ALDH1A1 P00352 3/20 0.55
TP53 P04637 1/20 0.53
CYP3A4 P08684 1/20 0.53
MAPK1 P28482 1/20 0.53
TDP1 Q9NUW8 2/20 0.50
POLB P06746 2/20 0.49
KDM4E B2RXH2 1/20 0.49
HSD17B10 Q99714 1/20 0.49
PPARG P37231 3/20 0.48
CNR2 P34972 1/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
MAPT P10636 1/20 0.48
CES2 O00748 1/20 0.47
CES1 P23141 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
APEX1 P27695 1/20 0.47
HTT P42858 1/20 0.47

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
SCHEMBL4911615 1.00 TSHR (0.56) TSHRLMNAALDH1A1TP53CYP3A4
SCHEMBL17097244 1.00 TSHR (0.56) TSHRLMNAALDH1A1TP53CYP3A4
SCHEMBL11804383 1.00 TSHR (0.56) TSHRLMNAALDH1A1TP53CYP3A4
SCHEMBL2722719 1.00 TSHR (0.56) TSHRLMNAALDH1A1TP53CYP3A4
SCHEMBL4903661 1.00 TSHR (0.56) TSHRLMNAALDH1A1TP53CYP3A4
SCHEMBL868427 1.00 TSHR (0.56) TSHRLMNAALDH1A1TP53CYP3A4
SCHEMBL2401337 0.98 TSHR (0.54) TSHRLMNAALDH1A1TP53CYP3A4
SCHEMBL316833 0.94 TSHR (0.53) TSHRLMNAALDH1A1TP53CYP3A4
SCHEMBL4912837 0.92 TDP1 (0.58) TSHRLMNAALDH1A1TDP1POLB
SCHEMBL10936220 0.89 TSHR (0.54) TSHRLMNAALDH1A1TP53TDP1

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
CN-116981758-A Thermally responsive brush polymers having a copolymer backbone and copolymer arms 英菲诺姆国际有限公司 2023-10-31 CN disclosed
US-6248805-B1 THERMAL INK JET PRNTING HEWLETT-PACKARD COMPANY 2001-06-19 US disclosed
US-3970606-A N-vinyl lactam interpolymers useful as thickening agents GAF CORPORATION (US) 1976-07-20 US disclosed