SCHEMBL878280

SCHEMBL878280

Cc1cc(Cl)ccc1O.c1ccc2c(c1)C2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 2/20 0.51
DRD2 P14416 7/20 0.43
DRD1 P21728 7/20 0.43
DRD5 P21918 7/20 0.43
DRD3 P35462 6/20 0.43
DRD4 P21917 4/20 0.42
HSD17B10 Q99714 3/20 0.42
TP53 P04637 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
TSHR P16473 1/20 0.42
KCNMA1 Q12791 1/20 0.42
ESR1 P03372 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
TLR8 Q9NR97 1/20 0.40
HPGD P15428 2/20 0.40
ALOX15 P16050 2/20 0.40
CYP3A4 P08684 1/20 0.40
HIF1A Q16665 1/20 0.40
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL171059 0.84
SCHEMBL28261421 0.82 ESR2 (0.59) ESR2HSD17B10TP53TDP1TSHR
Potassium SCHEMBL30562954 0.82 ESR2 (0.59) ESR2HSD17B10TP53TDP1TSHR
SCHEMBL30991479 0.82 ESR2 (0.59) ESR2HSD17B10TP53TDP1TSHR
SCHEMBL27457915 0.82 ESR2 (0.59) ESR2HSD17B10TP53TDP1TSHR
Orthocresol SCHEMBL9854564 0.76 TRPA1 (0.46) DRD2DRD1DRD5DRD3DRD4
2-Phenylphenol SCHEMBL574631 0.74 HPGD (0.57) ESR2HSD17B10TP53ESR1MEN1
SCHEMBL31196699 0.73 HTR2A (0.45) DRD2DRD1DRD5DRD3DRD4
SCHEMBL6905658 0.73 HTR2A (0.45) DRD2DRD1DRD5DRD3DRD4
SCHEMBL31196698 0.73 HTR2A (0.45) DRD2DRD1DRD5DRD3DRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10973935-B2 Stabilized nanobubbles for diagnostic and therapeutic applications CASE WESTERN RESERVE UNIVERSITY (US) 2021-04-13 US disclosed
US-20200061220-A1 STABILIZED NANOBUBBLES FOR DIAGNOSTIC AND THERAPEUTIC APPLICATIONS CASE WESTERN UNIVERSITY 2020-02-27 US disclosed
US-10357575-B2 Stabilized nanobubbles for diagnostic and therapeutic applications CASE WESTERN RESERVE UNIVERSITY (US) 2019-07-23 US disclosed
US-20160000824-A1 TOXICITY ENHANCING COMPOUNDS AND METHODS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-01-07 US disclosed
US-9132149-B2 Toxicity enhancing compounds and methods CASE WESTERN RESERVE UNIVERSITY (US) 2015-09-15 US disclosed
US-20140147390-A1 STABILIZED NANOBUBBLES FOR DIAGNOSTIC AND THERAPEUTIC APPLICATIONS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2014-05-29 US disclosed
US-20120225027-A1 TOXICITY ENHANCING COMPOUNDS AND METHODS CASE WESTERN RESERVE UNIVERSITY 2012-09-06 US disclosed
WO-2012040710-A2 STABILIZED NANOBUBBLES FOR DIAGNOSTIC AND THERAPEUTIC APPLICATIONS CASE WESTERN RESERVE UNIVERSITY (US) 2012-03-29 WO disclosed