SCHEMBL17754754

SCHEMBL17754754

CC(C)CC1(CC(C)C)c2ccccc2-c2ccc3oc4c(-c5ccccn5)cccc4c3c21

nearest known ligand 0.32

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.32
JAK1 P23458 1/20 0.32
TYK2 P29597 1/20 0.32
JAK3 P52333 1/20 0.32
HTR2C P28335 1/20 0.32
PDK2 Q15119 2/20 0.32
AHR P35869 1/20 0.31
KDM4E B2RXH2 1/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HSD17B10 Q99714 1/20 0.31
BRD4 O60885 1/20 0.30

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
SCHEMBL17754755 0.88 PRKDC (0.33)
SCHEMBL17759141 0.88 RET (0.30)
SCHEMBL17754756 0.87 PRKDC (0.31) PDK2
SCHEMBL17754748 0.87 NPC1 (0.30) NPC1
SCHEMBL17754750 0.84 AAK1 (0.31)
SCHEMBL17754751 0.82 AAK1 (0.30)
SCHEMBL17754749 0.82
SCHEMBL17759148 0.79
SCHEMBL17759301 0.78 PDK2 (0.32) PDK2KDM4ENPC1SMN1; SMN2
SCHEMBL17758926 0.76

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-20210083206-A1 Organic Electroluminescent Materials and Devices UNIVERSAL DISPLAY CORPORATION 2021-03-18 US disclosed
US-10868261-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2020-12-15 US disclosed
US-20160141522-A1 Organic Electroluminescent Materials and Devices UNIVERSAL DISPLAY CORPORATION 2016-05-19 US disclosed
US-20160141522-A1 Organic Electroluminescent Materials and Devices UNIVERSAL DISPLAY CORPORATION 2016-05-19 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10868261-B2 Organic electroluminescent materials and devices ICOSLG, CD274, PDCD1 JAK2 2083/4885JAK1 2500/4885TYK2 1139/4885
US-20160141522-A1 Organic Electroluminescent Materials and Devices EED, ICOSLG, OCIAD1 JAK2 1846/4885JAK1 2866/4885TYK2 1812/4885
US-20210083206-A1 Organic Electroluminescent Materials and Devices EED, ICOSLG, OCIAD1 JAK2 1846/4885JAK1 2866/4885TYK2 1812/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.