SCHEMBL17899284

SCHEMBL17899284

c1cc(-c2cccc(-c3ccc4c5c(cccc35)-c3ccccc3-4)c2)cc(-c2ccc3ccc4cccnc4c3n2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.42
CCR1 P32246 5/20 0.40
CCR8 P51685 5/20 0.40
CCR5 P51681 3/20 0.40
TSHR P16473 2/20 0.40
HIF1A Q16665 2/20 0.40
LMNA P02545 2/20 0.40
KDM4E B2RXH2 1/20 0.40
GMNN O75496 1/20 0.40
TP53 P04637 1/20 0.40
HSP90AA1 P07900 1/20 0.40
MMP2 P08253 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
MAPT P10636 1/20 0.40
MMP9 P14780 1/20 0.40
ALOX15 P16050 1/20 0.40
NFKB1 P19838 1/20 0.40
MMP8 P22894 1/20 0.40
THPO P40225 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
SCHEMBL17899288 0.99 BRD4 (0.43) BRD4CCR1CCR8CCR5TSHR
SCHEMBL17899296 0.95 CCR1 (0.38) BRD4CCR1CCR8CCR5TSHR
SCHEMBL11992174 0.94 BRD4 (0.41) BRD4CCR1CCR8CCR5TSHR
SCHEMBL17491082 0.94 CCR1 (0.41) BRD4CCR1CCR8CCR5TSHR
SCHEMBL17899283 0.92 BRD4 (0.40) BRD4CCR1CCR8CCR5TSHR
SCHEMBL17899312 0.91 ALDH1A1 (0.41) TSHRHIF1AKDM4EMAPTSMN1; SMN2
SCHEMBL11992190 0.91 BRD4 (0.39) BRD4CCR1CCR8CCR5TSHR
SCHEMBL17899308 0.90 PARP1 (0.40) TSHRHIF1ALMNAKDM4EMAPT
SCHEMBL19768284 0.90 POLB (0.43) BRD4LMNATP53MMP2CYP3A4
SCHEMBL11992181 0.89 BRD4 (0.40) BRD4CCR1CCR8CCR5TSHR

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-11552259-B1 Organic electroluminescent element and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2023-01-10 US disclosed
US-20220393113-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2022-12-08 US disclosed
US-20160197289-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2016-07-07 US disclosed
US-20160197289-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2016-07-07 US disclosed