SCHEMBL8891283

SCHEMBL8891283

CCCCCCCCCCCCCCCCCCc1c(O)ccc(C(C)(C)C)c1CCCCCCCCCCCCCCCCCC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 2/20 0.49
ESR1 P03372 2/20 0.43
ADRA2A P08913 2/20 0.43
ADORA3 P0DMS8 2/20 0.43
TACR2 P21452 2/20 0.43
SLC6A2 P23975 2/20 0.43
SLC6A4 P31645 2/20 0.43
SLC6A3 Q01959 2/20 0.43
TP53 P04637 2/20 0.43
CYP3A4 P08684 2/20 0.43
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HSD17B10 Q99714 2/20 0.43
LMNA P02545 1/20 0.43
SHBG P04278 1/20 0.43
HSPD1 P10809 1/20 0.43
ADRB3 P13945 1/20 0.43
HTR2C P28335 1/20 0.43
HSPE1 P61604 1/20 0.43
HIF1A Q16665 1/20 0.43

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
SCHEMBL11202288 1.00 TYR (0.49) TYRESR1ADRA2AADORA3TACR2
SCHEMBL11660171 1.00 TYR (0.49) TYRESR1ADRA2AADORA3TACR2
SCHEMBL688489 0.88 TYR (0.45) TYRESR1ADRA2AADORA3TACR2
SCHEMBL11239006 0.88 TYR (0.45) TYRESR1ADRA2AADORA3TACR2
SCHEMBL17965869 0.88 TYR (0.45) TYRESR1ADRA2AADORA3TACR2
SCHEMBL28101543 0.88 TYR (0.45) TYRESR1ADRA2AADORA3TACR2
SCHEMBL6271499 0.87 TYR (0.60) TYRESR1ADRA2AADORA3TACR2
SCHEMBL3441358 0.87 TYR (0.60) TYRESR1ADRA2AADORA3TACR2
SCHEMBL8936594 0.87 TYR (0.60) TYRESR1ADRA2AADORA3TACR2
SCHEMBL5143093 0.87 TYR (0.60) TYRESR1ADRA2AADORA3TACR2

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
EP-0792894-A2 Continuous modification of polyolefins in solid phase PCD-Polymere Gesellschaft m.b.H. (AT) 1997-09-03 EP disclosed