SCHEMBL17855767

SCHEMBL17855767

c1ccc(C2(c3ccccc3)c3ccccc3-c3cc(N(c4ccc(-c5cccc(-c6cccc7c6sc6ccccc67)c5)cc4)c4ccc(-c5cccc6c5oc5ccccc56)cc4)ccc32)cc1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.36
PRKDC P78527 2/20 0.33
GGPS1 O95749 1/20 0.33
PIK3CD O00329 1/20 0.30
BRD4 O60885 1/20 0.30
PIK3CA P42336 1/20 0.30
PIK3CB P42338 1/20 0.30
MTOR P42345 1/20 0.30
PIK3CG P48736 1/20 0.30
KCNH2 Q12809 1/20 0.30
BRDT Q58F21 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
SCHEMBL17855889 1.00 ALOX5 (0.36) ALOX5PRKDCGGPS1PIK3CDBRD4
SCHEMBL17855821 1.00 ALOX5 (0.36) ALOX5PRKDCGGPS1PIK3CDBRD4
SCHEMBL17855876 1.00 ALOX5 (0.36) ALOX5PRKDCGGPS1PIK3CDBRD4
SCHEMBL17855909 0.99 ALOX5 (0.37) ALOX5PRKDCGGPS1PIK3CDBRD4
SCHEMBL17855856 0.98 ALOX5 (0.36) ALOX5PRKDCGGPS1
SCHEMBL17855841 0.98 ALOX5 (0.36) ALOX5PRKDCGGPS1
SCHEMBL17855836 0.97 ALOX5 (0.36) ALOX5PRKDCGGPS1PIK3CDBRD4
SCHEMBL17855851 0.97 ALOX5 (0.36) ALOX5PRKDCGGPS1PIK3CDBRD4
SCHEMBL17855557 0.97 ALOX5 (0.36) ALOX5PRKDCGGPS1PIK3CDBRD4
SCHEMBL17855521 0.97 ALOX5 (0.36) ALOX5PRKDCGGPS1PIK3CDBRD4

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-20160181525-A1 COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT MATERIAL, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2016-06-23 US disclosed
US-20160181525-A1 COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT MATERIAL, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2016-06-23 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-20160181525-A1 COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT MATERIAL, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE ESR1, ESR2, CCNE2 ALOX5 1603/4885PRKDC 4864/4885GGPS1 3865/4885

“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.