SCHEMBL27296457

SCHEMBL27296457

CCCCC=CCCCCCCCC.CCCCCCl

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.65
ALDH1A1 P00352 1/20 0.65
FAAH O00519 5/20 0.56
TRPV1 Q8NER1 1/20 0.56
PPARA Q07869 4/20 0.48
TERT O14746 3/20 0.48
PTPN1 P18031 3/20 0.48
PPARG P37231 3/20 0.48
PPARD Q03181 3/20 0.48
CYP1A2 P05177 2/20 0.48
MAPT P10636 2/20 0.48
CYP2C19 P33261 2/20 0.48
BLM P54132 2/20 0.48
HSD17B10 Q99714 2/20 0.48
FABP4 P15090 2/20 0.48
F7 P08709 2/20 0.48
F3 P13726 2/20 0.48
KMT2A Q03164 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
GMNN O75496 1/20 0.48

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
SCHEMBL9174232 0.97 TSHR (0.68) TSHRALDH1A1FAAHTRPV1PPARA
SCHEMBL14244781 0.97 TSHR (0.68) TSHRALDH1A1FAAHTRPV1PPARA
SCHEMBL7044961 0.97 TSHR (0.68) TSHRALDH1A1FAAHTRPV1PPARA
SCHEMBL9839817 0.97 TSHR (0.68) TSHRALDH1A1FAAHTRPV1PPARA
SCHEMBL5250474 0.97 TSHR (0.60) TSHRALDH1A1FAAHTRPV1PPARA
SCHEMBL9175891 0.97 TSHR (0.68) TSHRALDH1A1FAAHTRPV1PPARA
SCHEMBL14245073 0.97 TSHR (0.60) TSHRALDH1A1FAAHTRPV1PPARA
SCHEMBL22654059 0.97 TSHR (0.68) TSHRALDH1A1FAAHTRPV1PPARA
SCHEMBL21412927 0.97 TSHR (0.68) TSHRALDH1A1FAAHTRPV1PPARA
SCHEMBL9173425 0.97 TSHR (0.68) TSHRALDH1A1FAAHTRPV1PPARA

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
CN-1035381-C Radicicol derivatives, their preparation and their anti-tumor activity SANKYO CO (JP) 1997-07-09 CN disclosed
CN-1059720-A Radicicol derivatives, its preparation method and anti-tumor activity thereof SANKYO CO (JP) 1992-03-25 CN disclosed