SCHEMBL25577688

SCHEMBL25577688

c1ccc(-c2ccccc2-c2c(-c3ccccc3)cccc2N(c2ccc(-c3ccc4sc5ccccc5c4c3)cc2)c2ccc(-c3cccc4c3sc3ccccc34)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.44
LIMK1 P53667 4/20 0.37
PIM3 Q86V86 2/20 0.34
PRKDC P78527 2/20 0.33
PARP14 Q460N5 1/20 0.32
TNKS O95271 1/20 0.32
TNKS2 Q9H2K2 1/20 0.32
F9 P00740 1/20 0.32
PTPN1 P18031 1/20 0.32
PIM1 P11309 1/20 0.31
PIM2 Q9P1W9 1/20 0.31

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
SCHEMBL25577639 0.96 ALOX5 (0.43) ALOX5LIMK1PIM3PRKDCPARP14
SCHEMBL25577442 0.95 ALOX5 (0.44) ALOX5LIMK1PRKDCPARP14TNKS
SCHEMBL25579327 0.95 ALOX5 (0.46) ALOX5LIMK1PIM3PRKDCPARP14
SCHEMBL25577686 0.94 PIM3 (0.37) ALOX5LIMK1PIM3F9PTPN1
SCHEMBL25579394 0.94 PIM3 (0.37) ALOX5LIMK1PIM3F9PTPN1
SCHEMBL25579375 0.94 PIM3 (0.37) ALOX5LIMK1PIM3F9PTPN1
SCHEMBL25577664 0.94 ALOX5 (0.40) ALOX5LIMK1PIM3PRKDCPARP14
SCHEMBL25577378 0.94 ALOX5 (0.39) ALOX5LIMK1PIM3PARP14TNKS
SCHEMBL25579335 0.93 PIM3 (0.36) ALOX5LIMK1PIM3F9PTPN1
SCHEMBL25579384 0.93 ALOX5 (0.46) ALOX5LIMK1PRKDCPARP14TNKS

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 110/4885PIM3 3816/4885

“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.