SCHEMBL24601592

SCHEMBL24601592

Cc1cc(C)c(-c2cccc3c2c2c4c5ccccc5n5c6cccc(-c7c(C)cc(C)cc7C)c6c(c6c7ccccc7n3c62)c45)c(C)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.38
CYP2A6 P11509 1/20 0.38
KDM4E B2RXH2 3/20 0.36
MAPT P10636 1/20 0.36
CRHR1 P34998 5/20 0.34
ALKBH5 Q6P6C2 1/20 0.34
FTO Q9C0B1 1/20 0.34
FLT3 P36888 1/20 0.32
NTRK1 P04629 1/20 0.32
CHEK1 O14757 1/20 0.31
PDK2 Q15119 1/20 0.31
LMNA P02545 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MCOLN3 Q8TDD5 1/20 0.31
HPGD P15428 1/20 0.30
BRD4 O60885 1/20 0.30
NQO2 P16083 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HTT P42858 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL24601506 0.85 FLT3 (0.35) CYP1A2CYP2A6KDM4EMAPTCRHR1
SCHEMBL24601480 0.84 FLT3 (0.34) CYP1A2CYP2A6KDM4EMAPTCRHR1
SCHEMBL25880372 0.82 CYP1A2 (0.40) CYP1A2CYP2A6KDM4EMAPTCRHR1
SCHEMBL24601308 0.81
SCHEMBL24601459 0.79 CYP1A2 (0.40) CYP1A2CYP2A6KDM4EMAPTCRHR1
SCHEMBL20857931 0.79 CYP1A2 (0.37) CYP1A2CYP2A6KDM4EMAPTCRHR1
SCHEMBL24601535 0.79 CYP1A2 (0.40) CYP1A2CYP2A6KDM4EMAPTCRHR1
SCHEMBL24601615 0.78 CYP1A2 (0.39) CYP1A2CYP2A6KDM4EMAPTALKBH5
SCHEMBL24601775 0.78 CHEK1 (0.32) CYP1A2CYP2A6FLT3CHEK1
SCHEMBL22178472 0.78 MAPT (0.49) CYP1A2CYP2A6KDM4EMAPTALKBH5

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 CYP1A2 4681/4885CYP2A6 4829/4885KDM4E 3163/4885

“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.