SCHEMBL19774530

SCHEMBL19774530

CC=C(C)CCCc1ccc(O)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 4/20 0.52
▸ ADRA2A P08913 3/20 0.52
▸ SLC6A2 P23975 3/20 0.52
▸ KDM4E B2RXH2 3/20 0.52
▸ ADORA3 P0DMS8 2/20 0.52
▸ TACR2 P21452 2/20 0.52
▸ SLC6A4 P31645 2/20 0.52
▸ SLC6A3 Q01959 2/20 0.52
▸ ALDH1A1 P00352 2/20 0.52
▸ LMNA P02545 1/20 0.52
▸ SHBG P04278 1/20 0.52
▸ TP53 P04637 1/20 0.52
▸ CYP3A4 P08684 1/20 0.52
▸ HSPD1 P10809 1/20 0.52
▸ ADRB3 P13945 1/20 0.52
▸ HTR2C P28335 1/20 0.52
▸ HSPE1 P61604 1/20 0.52
▸ HIF1A Q16665 1/20 0.52
▸ TST Q16762 1/20 0.52
▸ HSD17B10 Q99714 1/20 0.52

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
SCHEMBL10901560 0.81 ESR1 (0.57) ESR1ADRA2ASLC6A2KDM4EADORA3
SCHEMBL18678963 0.79 CALM1 (0.58) ESR1ALDH1A1ESR2CALM1CYP19A1
SCHEMBL11443937 0.79 ESR1 (0.55) ESR1ADRA2ASLC6A2KDM4EADORA3
SCHEMBL106915 0.78 ESR1 (0.53) ESR1ADRA2ASLC6A2KDM4EADORA3
SCHEMBL28395941 0.76 ESR1 (0.52) ESR1ADRA2ASLC6A2KDM4EADORA3
SCHEMBL9150568 0.75 ESR1 (0.55) ESR1ADRA2ASLC6A2KDM4EADORA3
SCHEMBL245139 0.75 ESR1 (0.77) ESR1ADRA2ASLC6A2KDM4EADORA3
SCHEMBL1171041 0.75 ESR1 (0.77) ESR1ADRA2ASLC6A2KDM4EADORA3
SCHEMBL449737 0.75 ESR1 (0.77) ESR1ADRA2ASLC6A2KDM4EADORA3
SCHEMBL744013 0.74 TRPV1 (0.55) ESR1ADRA2ASLC6A2KDM4EADORA3

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-2850130-B1 POLYCARBONATE COMPOSITION AND ARTICLES FORMED THEREFROM SABIC GLOBAL TECHNOLOGIES BV (NL) 2018-01-17 — — EP disclosed
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