SCHEMBL9066545

SCHEMBL9066545

C=CCCCC=CCCCCCCCCCCCCCC

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.80
ALDH1A1 P00352 1/20 0.62
FAAH O00519 2/20 0.56
TRPV1 Q8NER1 2/20 0.56
TERT O14746 2/20 0.48
GMNN O75496 1/20 0.48
USP2 O75604 1/20 0.48
LMNA P02545 1/20 0.48
CYP1A2 P05177 1/20 0.48
POLB P06746 1/20 0.48
MAPT P10636 1/20 0.48
CYP2C9 P11712 1/20 0.48
ALOX15 P16050 1/20 0.48
APEX1 P27695 1/20 0.48
CYP2C19 P33261 1/20 0.48
RECQL P46063 1/20 0.48
BLM P54132 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
HSD17B10 Q99714 1/20 0.48
DUSP3 P51452 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
SCHEMBL28682032 1.00 TSHR (0.80) TSHRALDH1A1FAAHTRPV1TERT
SCHEMBL11745402 1.00 TSHR (0.80) TSHRALDH1A1FAAHTRPV1TERT
SCHEMBL2634133 1.00 TSHR (0.80) TSHRALDH1A1FAAHTRPV1TERT
SCHEMBL25178920 1.00 TSHR (0.80) TSHRALDH1A1FAAHTRPV1TERT
SCHEMBL8852372 1.00 TSHR (0.80) TSHRALDH1A1FAAHTRPV1TERT
SCHEMBL25181828 1.00 TSHR (0.80) TSHRALDH1A1FAAHTRPV1TERT
SCHEMBL11745399 1.00 TSHR (0.80) TSHRALDH1A1FAAHTRPV1TERT
SCHEMBL25181781 1.00 TSHR (0.80) TSHRALDH1A1FAAHTRPV1TERT
SCHEMBL20543162 1.00 TSHR (0.80) TSHRALDH1A1FAAHTRPV1TERT
SCHEMBL28656032 1.00 TSHR (0.80) TSHRALDH1A1FAAHTRPV1TERT

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
EP-0474486-B1 Attractant compositions for fall webworm NITTO DENKO CORP (JP) 1996-02-28 EP claimed
CN-108688118-B Method for producing a polymer tube filled with liquid and sealed at fixed intervals and device for producing said polymer tube 信越化学工业株式会社 2021-12-14 CN disclosed
CN-104430334-A Attractant for Melanagromyza sojae SUZHOU YANDI INTELLIGENT SCIENCE & TECHNOLOGY CO LTD 2015-03-25 CN disclosed