SCHEMBL9500260

SCHEMBL9500260

CCCCc1ccc(C(O)CC)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.52
CA2 P00918 2/20 0.50
CA1 P00915 1/20 0.50
ALDH1A1 P00352 3/20 0.48
HSD17B10 Q99714 2/20 0.48
HPGD P15428 1/20 0.48
ESR1 P03372 2/20 0.47
ADRA2A P08913 2/20 0.47
ADORA3 P0DMS8 2/20 0.47
TACR2 P21452 2/20 0.47
SLC6A2 P23975 2/20 0.47
SLC6A4 P31645 2/20 0.47
SLC6A3 Q01959 2/20 0.47
KDM4E B2RXH2 1/20 0.47
SHBG P04278 1/20 0.47
TP53 P04637 1/20 0.47
CYP3A4 P08684 1/20 0.47
HSPD1 P10809 1/20 0.47
ADRB3 P13945 1/20 0.47
HTR2C P28335 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
SCHEMBL9498547 0.94 RARB (0.53) LMNACA2CA1ALDH1A1HSD17B10
SCHEMBL9500266 0.94 ESR1 (0.55) LMNAALDH1A1HSD17B10ESR1ADRA2A
SCHEMBL9501922 0.92 ESR1 (0.58) LMNAALDH1A1HSD17B10ESR1ADRA2A
SCHEMBL9499281 0.92 ESR1 (0.58) LMNAALDH1A1HSD17B10ESR1ADRA2A
SCHEMBL903623 0.92 ESR1 (0.58) LMNAALDH1A1HSD17B10ESR1ADRA2A
SCHEMBL9499420 0.92 ESR1 (0.58) LMNAALDH1A1HSD17B10ESR1ADRA2A
SCHEMBL9499018 0.92 ESR1 (0.58) LMNAALDH1A1HSD17B10ESR1ADRA2A
SCHEMBL9498512 0.92 ESR1 (0.58) LMNAALDH1A1HSD17B10ESR1ADRA2A
SCHEMBL9498144 0.92 ESR1 (0.58) LMNAALDH1A1HSD17B10ESR1ADRA2A
SCHEMBL547630 0.92 LMNA (0.56) LMNACA2CA1ALDH1A1HSD17B10

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-0354655-B1 1-PHENYL-1-PROPANOL DERIVATIVES CHISSO CORPORATION (JP) 1993-04-07 EP disclosed
US-5076947-A Optically active; free from temperature dependence CHISSO CORPORATION (JP) 1991-12-31 US disclosed
EP-0354655-A2 1-Phenyl-1-propanol derivatives CHISSO CORPORATION (JP) 1990-02-14 EP disclosed