SCHEMBL24601631

SCHEMBL24601631

N#Cc1ccc2c(c1)c1c3c4cc(C(F)(F)F)ccc4n4c5ccc(C#N)cc5c(c5c6cc(C(F)(F)F)ccc6n2c15)c34

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.44
CYP19A1 P11511 4/20 0.39
DDR1 Q08345 2/20 0.37
PTGDR2 Q9Y5Y4 3/20 0.37
DGAT1 O75907 1/20 0.36
SOAT1 P35610 1/20 0.36
KCNH2 Q12809 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
MRGPRX4 Q96LA9 1/20 0.34
TDO2 P48775 1/20 0.34
S1PR1 P21453 1/20 0.34
TMPRSS4 Q9NRS4 1/20 0.33
TRPV4 Q9HBA0 1/20 0.33
MAT2A P31153 1/20 0.33
CNR1 P21554 1/20 0.33
PTPN1 P18031 1/20 0.33
PTPN6 P29350 1/20 0.33
PTPN11 Q06124 1/20 0.33

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
SCHEMBL24601532 0.86 KIF11 (0.40) KIF11KCNH2
SCHEMBL24601621 0.86 KDM4E (0.36) CYP19A1
SCHEMBL24601626 0.80 ENPP3 (0.35) CYP19A1
SCHEMBL24601628 0.80 KIF11 (0.42) KIF11KCNH2MAT2A
SCHEMBL24601749 0.78 CA1 (0.40)
SCHEMBL22178496 0.78 KIF11 (0.49) KIF11L3MBTL1
SCHEMBL19967774 0.70 TDO2 (0.37) KIF11CYP19A1DDR1DGAT1SOAT1
SCHEMBL21399481 0.70 KIF11 (0.40) KIF11DDR1PTGDR2DGAT1SOAT1
SCHEMBL21399482 0.70 KIF11 (0.40) KIF11DDR1PTGDR2DGAT1SOAT1
SCHEMBL21399478 0.70 KIF11 (0.40) KIF11CYP19A1DDR1PTGDR2DGAT1

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 KIF11 3347/4885CYP19A1 4125/4885DDR1 3711/4885

“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.