SCHEMBL17547775

SCHEMBL17547775

Cc1ccccc1-c1ccc(N(c2ccc(-c3ccc(-c4cccc5c4oc4ccccc45)cc3)cc2)c2ccc(-c3ccc(-c4cccc5c4oc4ccccc45)cc3)cc2)cc1C

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.48
GGPS1 O95749 1/20 0.37
PRKDC P78527 6/20 0.37
PTGES2 Q9H7Z7 1/20 0.35
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CA9 Q16790 2/20 0.34
TNKS O95271 1/20 0.34
ATM Q13315 2/20 0.33
HDAC8 Q9BY41 1/20 0.32
CDC14B O60729 2/20 0.31
CDC14A Q9UNH5 2/20 0.31
PIK3CD O00329 1/20 0.31
PIK3CB P42338 1/20 0.31
PRMT5 O14744 1/20 0.31
WDR77 Q9BQA1 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
SCHEMBL17547772 0.98 ALOX5 (0.46) ALOX5GGPS1PRKDCPTGES2CA12
SCHEMBL16883116 0.94 ALOX5 (0.45) ALOX5GGPS1PRKDCPTGES2CA12
SCHEMBL15808000 0.92 ALOX5 (0.50) ALOX5GGPS1PRKDCPTGES2CA12
SCHEMBL15807997 0.92 ALOX5 (0.50) ALOX5GGPS1PRKDCPTGES2CA12
SCHEMBL17734660 0.91 ALOX5 (0.46) ALOX5GGPS1PRKDCPTGES2CA12
SCHEMBL18362735 0.90 ALOX5 (0.46) ALOX5GGPS1PRKDCPTGES2CA12
SCHEMBL18362689 0.90 ALOX5 (0.44) ALOX5GGPS1PRKDCPTGES2CA12
SCHEMBL18362690 0.90 ALOX5 (0.44) ALOX5GGPS1PRKDCPTGES2CA12
SCHEMBL17547773 0.90 ALOX5 (0.40) ALOX5GGPS1PRKDCPTGES2
SCHEMBL16996375 0.90 ALOX5 (0.41) ALOX5GGPS1PRKDCPTGES2

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-9614160-B2 Aromatic amine derivatives and organic electroluminescent elements using same IDEMITSU KOSAN CO., LTD. (JP) 2017-04-04 US disclosed
US-20160064669-A1 AROMATIC AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT ELEMENTS USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2016-03-03 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-20160064669-A1 AROMATIC AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT ELEMENTS USING SAME PNMT, TYR, AOC2 ALOX5 1407/4885GGPS1 3849/4885PRKDC 4060/4885

“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.