SCHEMBL22248702

SCHEMBL22248702

CC(C)(C)c1ccc(OCCCCOc2ccc(C(C)(C)C)cc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 8/20 0.62
KDM4E B2RXH2 3/20 0.59
SMN1; SMN2 Q16637 3/20 0.57
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
POLB P06746 2/20 0.56
APP P05067 1/20 0.53
MITF O75030 2/20 0.51
RAB9A P51151 2/20 0.51
NPC1 O15118 1/20 0.51
LMNA P02545 1/20 0.51
TP53 P04637 1/20 0.51
GAA P10253 1/20 0.50
ALDH1A1 P00352 1/20 0.49
CYP3A4 P08684 1/20 0.48

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
SCHEMBL22248703 0.98 HRH3 (0.65) HRH3KDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL20234326 0.95 HRH3 (0.61) HRH3KDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL7855901 0.92 NR5A1 (0.58) HRH3KDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL10202420 0.92 HRH3 (0.55) HRH3KDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL9593021 0.91 HRH3 (0.57) HRH3KDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL23266158 0.90 NR5A1 (0.61) HRH3KDM4ERAB9ANPC1LMNA
SCHEMBL21633733 0.90 HRH3 (0.54) HRH3KDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL22275949 0.90 HRH3 (0.54) HRH3KDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL12372939 0.90 HRH3 (0.58) HRH3KDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL12762363 0.90 NR5A1 (0.61) HRH3KDM4ERAB9ANPC1LMNA

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-11472901-B2 Polymer, coating composition comprising same, and organic light-emitting device using same LG CHEM, LTD. 2022-10-18 US disclosed
US-11374175-B2 Polymer, coating composition comprising same, and organic light-emitting device using same LG CHEM, LTD. 2022-06-28 US disclosed
US-20200239610-A1 Polymer, Coating Composition Comprising Same, and Organic Light-Emitting Device Using Same LG CHEM, LTD. (KR) 2020-07-30 US disclosed
US-20200235301-A1 Polymer, Coating Composition Comprising Same, and Organic Light-Emitting Device Using Same LG CHEM, LTD. (KR) 2020-07-23 US disclosed