SCHEMBL24601801

SCHEMBL24601801

CC(C)(C)c1ccc(-c2cc(-c3ccccc3)c(-c3ccc4c(c3)c3c5c6ccccc6n6c7ccc(-c8c(-c9ccccc9)cc(-c9ccc(C(C)(C)C)cc9)cc8-c8ccccc8)cc7c(c7c8ccccc8n4c73)c56)c(-c3ccccc3)c2)cc1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.37
TSPO P30536 1/20 0.35
SERPINE1 P05121 3/20 0.35
CYP19A1 P11511 2/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
SGK1 O00141 1/20 0.33
NR1H4 Q96RI1 1/20 0.33
HSD17B2 P37059 1/20 0.33
DHODH Q02127 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TP53 P04637 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
KIF11 P52732 1/20 0.31

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
SCHEMBL24601800 0.94 GPR84 (0.37) GPR84SERPINE1ALDH1A1MAPTMAPK1
SCHEMBL24601591 0.94 SERPINE1 (0.37) GPR84SERPINE1CYP19A1ALDH1A1MAPT
SCHEMBL24601596 0.93 SERPINE1 (0.36) GPR84SERPINE1CYP19A1HSD17B2DHODH
SCHEMBL24601787 0.91 GPR84 (0.34) GPR84TSPOSERPINE1ALDH1A1MAPT
SCHEMBL24601598 0.91 SERPINE1 (0.38) GPR84SERPINE1CYP19A1ALDH1A1MAPT
SCHEMBL24601804 0.90 TSPO (0.35) GPR84TSPOHSD17B10
SCHEMBL24601643 0.88 DNMT1 (0.36) GPR84TSPOSERPINE1ALDH1A1MAPT
SCHEMBL24601567 0.88 SERPINE1 (0.37) GPR84SERPINE1CYP19A1ALDH1A1MAPT
SCHEMBL24601457 0.87 TSPO (0.38) TSPOSERPINE1ALDH1A1MAPTMAPK1
SCHEMBL24601542 0.87 TSPO (0.38) TSPOSERPINE1ALDH1A1MAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220213113-A1 NITROGEN-CONTAINING CONDENSED CYCLIC COMPOUNDS, FLUORESCENCE EMITTERS, ORGANIC ELECTROLUMINESCENT DEVICES, AND MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES SAMSUNG ELECTRONICS CO., LTD. (KR) 2022-07-07 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 (1 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-20220213113-A1 NITROGEN-CONTAINING CONDENSED CYCLIC COMPOUNDS, FLUORESCENCE EMITTERS, ORGANIC ELECTROLUMINESCENT DEVICES, AND MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES NCL, NOC2L, NOLC1 GPR84 4574/4885TSPO 3404/4885SERPINE1 4819/4885

“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.