SCHEMBL22681192

SCHEMBL22681192

CC(C)c1ccc(C(C)(C)c2ccc(OCC(O)CO)cc2)cc1

nearest known ligand 0.72

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AR P10275 4/20 0.72
HTT P42858 2/20 0.57
HIF1A Q16665 1/20 0.57
KMT2A Q03164 4/20 0.50
MEN1 O00255 2/20 0.48
MAPK1 P28482 3/20 0.45
ALDH1A1 P00352 2/20 0.45
KDM4E B2RXH2 1/20 0.45
MAPT P10636 4/20 0.44
LMNA P02545 3/20 0.44
GAA P10253 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
TSHR P16473 1/20 0.43
VDR P11473 3/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL868711 0.91 AR (0.85) ARHTTHIF1AKMT2AMEN1
SCHEMBL12363856 0.91 AR (0.85) ARHTTHIF1AKMT2AMEN1
SCHEMBL12570312 0.89 AR (0.82) ARHTTHIF1AKMT2AMEN1
SCHEMBL15801265 0.89 KMT2A (0.59) ARHTTKMT2AMEN1MAPK1
SCHEMBL8541521 0.89 KMT2A (0.59) ARHTTKMT2AMEN1MAPK1
SCHEMBL15801262 0.89 KMT2A (0.59) ARHTTKMT2AMEN1MAPK1
SCHEMBL13513140 0.88 AR (0.76) ARHTTHIF1AKMT2AMEN1
SCHEMBL12267202 0.87 AR (0.74) ARHTTHIF1AKMT2AMEN1
SCHEMBL23992613 0.86 HTT (0.54) ARHTTHIF1AKMT2AMEN1
SCHEMBL11658489 0.86 AR (0.78) ARHTTHIF1AKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230323016-A1 AMBIENT TEMPERATURE CURABLE COATING AND USES THEREIN WASHINGTON STATE UNIVERSITY 2023-10-12 US disclosed
US-20230158546-A1 APPARATUS LG DISPLAY CO., LTD. (KR) 2023-05-25 US disclosed
US-20230134156-A1 EPOXY RESIN AND ELECTRODEPOSITION PAINT KANSAI PAINT CO., LTD. (JP) 2023-05-04 US disclosed
WO-2020230786-A1 CURABLE COMPOSITION AND CURED PRODUCT OF SAME 学校法人関西大学 2020-11-19 WO disclosed