SCHEMBL9917176

SCHEMBL9917176

Cc1ccc(-c2ccc(-c3ccc4oc5ccc(-c6ccccc6)cc5c4c3)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 5/20 0.50
▸ KDM4E B2RXH2 5/20 0.50
▸ MAPT P10636 4/20 0.50
▸ ALDH1A1 P00352 4/20 0.50
▸ PLA2G2A P14555 3/20 0.50
▸ PLA2G4A P47712 3/20 0.50
▸ TP53 P04637 2/20 0.50
▸ HSD17B10 Q99714 2/20 0.50
▸ GAA P10253 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ CYP3A4 P08684 1/20 0.50
▸ NPC1 O15118 4/20 0.49
▸ RAB9A P51151 4/20 0.49
▸ SMN1; SMN2 Q16637 4/20 0.49
▸ POLB P06746 2/20 0.49
▸ CASP3 P42574 1/20 0.49
▸ SENP8 Q96LD8 1/20 0.49
▸ SENP7 Q9BQF6 1/20 0.49
▸ SENP6 Q9GZR1 1/20 0.49
▸ NFKB1 P19838 1/20 0.48

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
SCHEMBL9917222 1.00 HPGD (0.50) HPGDKDM4EMAPTALDH1A1PLA2G2A
SCHEMBL12203234 0.94 KDM4E (0.57) HPGDKDM4EMAPTALDH1A1PLA2G2A
SCHEMBL9917227 0.94 KDM4E (0.57) HPGDKDM4EMAPTALDH1A1PLA2G2A
SCHEMBL12969268 0.92 PLA2G2A (0.50) HPGDKDM4EMAPTALDH1A1PLA2G2A
SCHEMBL22906754 0.91 KDM4E (0.54) HPGDKDM4EMAPTALDH1A1PLA2G2A
SCHEMBL9917112 0.91 MAOB (0.54) HPGDKDM4EMAPTALDH1A1PLA2G2A
SCHEMBL9917206 0.91 MAOB (0.54) HPGDKDM4EMAPTALDH1A1PLA2G2A
SCHEMBL9917160 0.91 MAOB (0.54) HPGDKDM4EMAPTALDH1A1PLA2G2A
SCHEMBL9917181 0.91 MAOB (0.54) HPGDKDM4EMAPTALDH1A1PLA2G2A
SCHEMBL16158757 0.90 L3MBTL1 (0.50) HPGDKDM4EMAPTALDH1A1PLA2G2A

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 HPGD 4080/4885KDM4E 1053/4885MAPT 2113/4885
US-20120146014-A1 AROMATIC AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT ELEMENTS USING SAME PNMT, TYR, AOC2 HPGD 3636/4885KDM4E 141/4885MAPT 245/4885
US-20160064669-A1 AROMATIC AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT ELEMENTS USING SAME PNMT, TYR, AOC2 HPGD 3636/4885KDM4E 141/4885MAPT 245/4885

“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.

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