SCHEMBL9720056

SCHEMBL9720056

c1cc2c(cc1OCCOc1ccc3c(c1)CCCC3)CCCC2

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.64
PPARD Q03181 3/20 0.64
SMN1; SMN2 Q16637 3/20 0.63
ALOX15 P16050 3/20 0.62
TSHR P16473 2/20 0.62
HSD17B10 Q99714 1/20 0.62
PPARA Q07869 1/20 0.57
NPC1 O15118 2/20 0.57
RAB9A P51151 2/20 0.57
NFKB1 P19838 1/20 0.57
NFKB2 Q00653 1/20 0.57
RELA Q04206 1/20 0.57
KDM4E B2RXH2 2/20 0.54
POLB P06746 1/20 0.54
STS P08842 1/20 0.53
RXRA P19793 3/20 0.53
RXRB P28702 3/20 0.53
RXRG P48443 3/20 0.53
ALDH1A1 P00352 2/20 0.52
HRH3 Q9Y5N1 1/20 0.51

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
SCHEMBL9720055 0.94 ALOX15 (0.59) PPARGPPARDSMN1; SMN2ALOX15TSHR
SCHEMBL5905854 0.91 PPARG (0.58) PPARGPPARDSMN1; SMN2ALOX15TSHR
SCHEMBL9720017 0.91 PPARG (0.64) PPARGPPARDSMN1; SMN2ALOX15TSHR
SCHEMBL20005309 0.89 PPARG (0.57) PPARGPPARDSMN1; SMN2ALOX15TSHR
SCHEMBL30778174 0.88 TSHR (0.60) PPARGPPARDSMN1; SMN2ALOX15TSHR
SCHEMBL73017 0.88 TSHR (0.56) PPARGPPARDSMN1; SMN2ALOX15TSHR
SCHEMBL11444799 0.88 TSHR (0.56) PPARGPPARDSMN1; SMN2ALOX15TSHR
SCHEMBL15625383 0.88 KDM4E (0.56) PPARGPPARDSMN1; SMN2ALOX15TSHR
SCHEMBL10439500 0.87 ALOX15 (0.54) PPARGPPARDSMN1; SMN2ALOX15TSHR
SCHEMBL22692730 0.85 KDM4E (0.54) PPARGPPARDSMN1; SMN2ALOX15TSHR

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5081099-A A tetrahydronaphthalene sensitizer as antifogging agent; storage stability ADEKA ARGUS CHEMICAL CO., LTD. (JP) 1992-01-14 US disclosed