SCHEMBL25850723

SCHEMBL25850723

c1ccc(-c2cnc3c(ccc4ccc(-c5cccc(-c6cccc7c6ccc6c8ccccc8sc76)n5)nc43)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.39
ALOX5 P09917 1/20 0.36
PARP1 P09874 1/20 0.36
F9 P00740 1/20 0.34
CDC7 O00311 1/20 0.34
CLK1 P49759 1/20 0.34
DBF4 Q9UBU7 1/20 0.34
LIMK1 P53667 5/20 0.32
CYP1A1 P04798 1/20 0.32
CYP1B1 Q16678 1/20 0.32
TNKS O95271 1/20 0.32
TNKS2 Q9H2K2 1/20 0.32
EGLN3 Q9H6Z9 1/20 0.31
MAPT P10636 1/20 0.31
KRAS P01116 1/20 0.31
DNPH1 O43598 1/20 0.30
PARP14 Q460N5 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
SCHEMBL17899353 0.87 ALOX5 (0.41) KDM4EALOX5PARP1F9LIMK1
SCHEMBL21119944 0.81 ALOX5 (0.43) ALOX5PARP1F9LIMK1CYP1A1
SCHEMBL21119860 0.80 ALOX5 (0.38) KDM4EALOX5PARP1F9LIMK1
SCHEMBL19767385 0.79 ALOX5 (0.53) KDM4EALOX5PARP1LIMK1MAPT
SCHEMBL26468602 0.79 ALOX5 (0.30) KDM4EALOX5
SCHEMBL21119854 0.78 ALOX5 (0.39) ALOX5PARP1F9LIMK1CYP1A1
SCHEMBL21119914 0.77 ALOX5 (0.42) KDM4EALOX5LIMK1CYP1A1CYP1B1
SCHEMBL15582280 0.77 ALOX5 (0.46) ALOX5LIMK1MAPTKRASPARP14
SCHEMBL21119688 0.77 LIMK1 (0.40) ALOX5PARP1F9LIMK1CYP1A1
SCHEMBL15582068 0.77 ALOX5 (0.42) ALOX5PARP1F9LIMK1TNKS

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-11711972-B1 Organic electronic element comprising compound for organic electronic element and an electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2023-07-25 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-11711972-B1 Organic electronic element comprising compound for organic electronic element and an electronic device thereof PPOX, ESR1, CCNE2 KDM4E 1749/4885ALOX5 2117/4885PARP1 1212/4885

“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.