SCHEMBL25577440

SCHEMBL25577440

c1ccc(-c2ccccc2-c2c(-c3ccccc3)cccc2N(c2ccc(-c3cccc4c3sc3ccccc34)cc2)c2ccc3c(c2)sc2ccccc23)cc1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.44
LIMK1 P53667 7/20 0.36
PRKDC P78527 3/20 0.35
F9 P00740 1/20 0.34
PARP14 Q460N5 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TNKS O95271 1/20 0.32
TNKS2 Q9H2K2 1/20 0.32
ABCB1 P08183 1/20 0.31
GPR3 P46089 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
SCHEMBL25577314 0.95 ALOX5 (0.44) ALOX5LIMK1PRKDCF9PARP14
SCHEMBL25577711 0.95 ALOX5 (0.44) ALOX5LIMK1PRKDCF9PARP14
SCHEMBL25577442 0.94 ALOX5 (0.44) ALOX5LIMK1PRKDCF9PARP14
SCHEMBL24856514 0.93 ALOX5 (0.41) ALOX5LIMK1PRKDCF9PARP14
SCHEMBL24856364 0.93 F9 (0.37) ALOX5LIMK1F9ALDH1A1MAPT
SCHEMBL25578825 0.93 F9 (0.37) ALOX5LIMK1F9ALDH1A1MAPT
SCHEMBL25577713 0.93 ALOX5 (0.47) ALOX5LIMK1PRKDCF9PARP14
SCHEMBL25577633 0.93 ALOX5 (0.43) ALOX5LIMK1PRKDCF9PARP14
SCHEMBL25577641 0.92 ALOX5 (0.48) ALOX5LIMK1PRKDCF9PARP14
SCHEMBL24856504 0.92 F9 (0.38) ALOX5LIMK1F9ALDH1A1MAPT

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-20230180597-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2023-06-08 US disclosed
US-20230180597-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2023-06-08 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-20230180597-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE ESR1, L1CAM, ESR2 ALOX5 1615/4885LIMK1 110/4885PRKDC 4878/4885

“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.