SCHEMBL25544995

SCHEMBL25544995

N#Cc1cc(C#N)cc(-c2ccc(N(c3ccc(-c4ccc5c(c4)sc4cc(C#N)ccc45)cc3)c3ccc(-c4ccc5c(c4)sc4cc(C#N)ccc45)cc3)cc2)c1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 1/20 0.41
APP P05067 3/20 0.40
G6PD P11413 1/20 0.32
XDH P47989 2/20 0.32
SLC22A12 Q96S37 2/20 0.32
MMP3 P08254 1/20 0.31
MIF P14174 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
MAP4K4 O95819 1/20 0.31
PIM1 P11309 1/20 0.31
PIM3 Q86V86 1/20 0.31
PIM2 Q9P1W9 1/20 0.31
ESR1 P03372 1/20 0.31
KIF11 P52732 1/20 0.31
PGR P06401 1/20 0.30
CYP19A1 P11511 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
SCHEMBL26289025 0.94 LIMK1 (0.41) LIMK1APPG6PDXDHSLC22A12
SCHEMBL25544860 0.93 LIMK1 (0.47) LIMK1APPG6PDMMP3HRH3
SCHEMBL25544991 0.93 LIMK1 (0.47) LIMK1APPG6PDMMP3HRH3
SCHEMBL25545000 0.90 LIMK1 (0.48) LIMK1APPG6PDMMP3HRH3
SCHEMBL25544986 0.89 LIMK1 (0.41) LIMK1APPG6PDXDHSLC22A12
SCHEMBL25544852 0.89 LIMK1 (0.41) LIMK1APPG6PD
SCHEMBL25544998 0.86 LIMK1 (0.40) LIMK1APPG6PD
SCHEMBL26289003 0.85 LIMK1 (0.39) LIMK1APPG6PDHRH3
SCHEMBL25544848 0.82 APP (0.38) LIMK1APPG6PDMIF
SCHEMBL25544842 0.82 APP (0.40) LIMK1APPG6PDMIFESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230301181-A1 TERTIARY AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME LAPTO CO., LTD. (KR) 2023-09-21 US disclosed
EP-4183784-A1 TERTIARY AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME Lapto Co., Ltd. (KR) 2023-05-24 EP 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-20230301181-A1 TERTIARY AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME SAT1, FTO, SETDB1 LIMK1 116/4885APP 2445/4885G6PD 1833/4885

“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.