SCHEMBL25544842

SCHEMBL25544842

N#Cc1ccc(N(c2ccc3c(c2)sc2cc(C#N)ccc23)c2ccc3c(c2)sc2cc(C#N)ccc23)cc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
APP P05067 3/20 0.40
LIMK1 P53667 1/20 0.38
G6PD P11413 2/20 0.36
MIF P14174 2/20 0.35
CLK1 P49759 1/20 0.33
CYP2A6 P11509 3/20 0.32
ENPP2 Q13822 1/20 0.32
DYRK1A Q13627 1/20 0.32
ESR1 P03372 1/20 0.32
CA2 P00918 3/20 0.31
ALDH1A1 P00352 1/20 0.31
CA12 O43570 1/20 0.31
CA3 P07451 1/20 0.31
CA6 P23280 1/20 0.31
CA9 Q16790 1/20 0.31
CA14 Q9ULX7 1/20 0.31
CA1 P00915 2/20 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
SCHEMBL25545000 0.93 LIMK1 (0.48) APPLIMK1G6PDESR1
SCHEMBL25544854 0.92 G6PD (0.43) APPLIMK1G6PDMIFCA2
SCHEMBL25544848 0.90 APP (0.38) APPLIMK1G6PDMIFCYP2A6
SCHEMBL25544991 0.89 LIMK1 (0.47) APPLIMK1G6PDESR1
SCHEMBL25544860 0.89 LIMK1 (0.47) APPLIMK1G6PDESR1
SCHEMBL25544846 0.88 APP (0.36) APPLIMK1G6PDMIF
SCHEMBL17936144 0.85 LIMK1 (0.41) APPLIMK1G6PD
SCHEMBL17936166 0.85 CA1 (0.38) APPLIMK1G6PDCLK1CA2
SCHEMBL549183 0.84 G6PD (0.45) APPLIMK1G6PDMIFCYP2A6
SCHEMBL25544995 0.82 LIMK1 (0.41) APPLIMK1G6PDMIFESR1

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 APP 2445/4885LIMK1 116/4885G6PD 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.