Sugi Predict

Sugi Predict / Compounds / SCHEMBL9917241

SCHEMBL9917241

SCHEMBL9917241

Cc1ccc2c(c1)C(C)(C)c1cc(-c3cc4c5ccccc5oc4c4ccccc34)ccc1-2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.41
▸ MAOB P27338 2/20 0.37
▸ TNKS O95271 1/20 0.37
▸ PARP1 P09874 1/20 0.37
▸ TNKS2 Q9H2K2 1/20 0.37
▸ PARP2 Q9UGN5 1/20 0.37
▸ PGR P06401 2/20 0.36
▸ AHR P35869 1/20 0.35
▸ LMNA P02545 2/20 0.34
▸ PRKDC P78527 1/20 0.34
▸ MEN1 O00255 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ RET P07949 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ ALOX12 P18054 1/20 0.33
▸ KDR P35968 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33

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
SCHEMBL9917146 0.90 ALOX5 (0.53) ALOX5MAOBTNKSPARP1TNKS2
SCHEMBL9917235 0.88 ALOX5 (0.51) ALOX5MAOBTNKSPARP1TNKS2
SCHEMBL17945185 0.85 ALOX5 (0.40) ALOX5PGRAHRLMNAPRKDC
SCHEMBL9916214 0.84 TNKS (0.41) ALOX5TNKSPARP1TNKS2PARP2
SCHEMBL13171134 0.83 TNKS (0.40) ALOX5TNKSPGRAHRPRKDC
SCHEMBL9917183 0.83 MAOB (0.43) MAOBTNKSPARP1TNKS2PARP2
SCHEMBL9917145 0.83 PGR (0.40) MAOBTNKSPARP1TNKS2PARP2
SCHEMBL20276869 0.83 ALOX5 (0.59) ALOX5PGRAHRPRKDCMEN1
SCHEMBL10122498 0.82 ALOX5 (0.38) ALOX5PGRAHRPRKDCMEN1
SCHEMBL13171124 0.82 PDK2 (0.42) ALOX5TNKSPGRAHRPRKDC

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170162790-A1 AROMATIC AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT ELEMENTS USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2017-06-08 — — US disclosed
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
US-9260390-B2 Aromatic amine derivatives and organic electroluminescent elements using same IDEMITSU KOSAN CO., LTD. (JP) 2016-02-16 — — US disclosed
US-20120146014-A1 AROMATIC AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT ELEMENTS USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2012-06-14 — — 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 (3 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-20170162790-A1 AROMATIC AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT ELEMENTS USING SAME RER1, NR4A1, REL ALOX5 1894/4885MAOB 331/4885TNKS 4121/4885
US-20120146014-A1 AROMATIC AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT ELEMENTS USING SAME PNMT, TYR, AOC2 ALOX5 1407/4885MAOB 208/4885TNKS 3400/4885
US-20160064669-A1 AROMATIC AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT ELEMENTS USING SAME PNMT, TYR, AOC2 ALOX5 1407/4885MAOB 208/4885TNKS 3400/4885

“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.