SCHEMBL24601401

SCHEMBL24601401

CC(C)(C)c1ccc(C(C)(C)c2ccc3c(c2)c2c4c5ccc(-c6ccccc6)cc5n5c6ccc(C(C)(C)c7ccc(C(C)(C)C)cc7)cc6c(c6c7ccc(-c8ccccc8)cc7n3c26)c45)cc1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 4/20 0.37
CYP19A1 P11511 2/20 0.36
HSD17B2 P37059 1/20 0.36
MAOB P27338 1/20 0.34
GRM2 Q14416 1/20 0.33
DHODH Q02127 1/20 0.33
LIMK1 P53667 1/20 0.32
CNR1 P21554 2/20 0.32
CNR2 P34972 1/20 0.32
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
KIF11 P52732 1/20 0.32
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
MAPK1 P28482 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
TSPO P30536 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
SCHEMBL24601405 0.95 CNR1 (0.36) SERPINE1CYP19A1HSD17B2MAOBGRM2
SCHEMBL24601425 0.94 RXRA (0.35) SERPINE1CYP19A1HSD17B2MAOBGRM2
SCHEMBL24601402 0.94 HSD17B2 (0.38) SERPINE1CYP19A1HSD17B2MAOBGRM2
SCHEMBL24601515 0.91 HSD17B2 (0.35) SERPINE1HSD17B2MAOBDHODHLIMK1
SCHEMBL24601502 0.91 RXRB (0.33) SERPINE1CNR1CNR2RXRARXRB
SCHEMBL24601397 0.89 CNR1 (0.38) HSD17B2MAOBGRM2LIMK1CNR1
SCHEMBL24601422 0.87 RXRA (0.38) SERPINE1HSD17B2MAOBGRM2LIMK1
SCHEMBL24601672 0.87 KIF11 (0.36) SERPINE1HSD17B2KIF11ALDH1A1
SCHEMBL24601428 0.86 ESR1 (0.37) MAOBGRM2LIMK1CNR1CNR2
SCHEMBL24601540 0.86 ALDH1A1 (0.37) SERPINE1HSD17B2MAOBRXRARXRB

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 SERPINE1 4819/4885CYP19A1 4125/4885HSD17B2 4842/4885

“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.