Sugi Predict

Sugi Predict / Compounds / SCHEMBL21044856

SCHEMBL21044856

SCHEMBL21044856

COc1ccc(C(=O)Nc2ccccc2)cc1N/N=C1\C(=O)C(C(=O)Nc2cccc([N+](=O)[O-])c2)=Cc2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 13/20 0.54
▸ KMT2A Q03164 13/20 0.54
▸ SETD7 Q8WTS6 2/20 0.48
▸ ALDH1A1 P00352 6/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ TSHR P16473 1/20 0.47
▸ MAPT P10636 6/20 0.44
▸ LMNA P02545 4/20 0.44
▸ POLB P06746 4/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ HTT P42858 2/20 0.44
▸ MAPK1 P28482 2/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ BLM P54132 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43

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
SCHEMBL5421220 0.93 MEN1 (0.48) MEN1KMT2ASETD7ALDH1A1MAPT
SCHEMBL21044834 0.90 KMT2A (0.48) MEN1KMT2AALDH1A1TDP1CYP3A4
SCHEMBL29351700 0.90 KMT2A (0.48) MEN1KMT2AALDH1A1TDP1CYP3A4
SCHEMBL21436712 0.87 KMT2A (0.47) MEN1KMT2AALDH1A1TDP1CYP3A4
SCHEMBL10036416 0.86 MEN1 (0.48) MEN1KMT2AALDH1A1TSHRMAPT
SCHEMBL21436648 0.84 MEN1 (0.47) MEN1KMT2AALDH1A1TDP1CYP3A4
SCHEMBL17491828 0.84 KMT2A (0.47) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL12393169 0.84 KMT2A (0.47) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL29366309 0.83 POLB (0.48) MEN1KMT2AMAPTLMNAPOLB
SCHEMBL21436714 0.83 POLB (0.48) MEN1KMT2AMAPTLMNAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230310300-A1 HAIR COLOURING COMPOSITIONS COMPRISING A BIO-BASED POLYMER AND A CROSSLINKER HFC PRESTIGE SERVICE GERMINY GMBH (DE) 2023-10-05 — — US disclosed
CN-109478029-B Magenta toner 日本瑞翁株式会社 2022-07-29 — — CN disclosed
US-11324688-B2 Bicomponent composition WELLA INTERNATIONAL OPERATIONS SWI (CH) 2022-05-10 — — US disclosed
US-20220054392-A1 MULTICOMPONENT IN SITU COLORATION COMPOSITION WELLA INTERNATIONAL OPERATIONS SWITZERLAND SÀRL (CH) 2022-02-24 — — US disclosed
US-20220016017-A1 COLOR COATINGS WITH DOWNSTREAM FEATURES HFC PRESTIGE SERVICE GERMANY GMBH (DE) 2022-01-20 — — US disclosed
US-11226569-B2 Magenta toner ZEON CORPORATION (JP) 2022-01-18 — — US disclosed
EP-3890683-A1 MULTICOMPONENT IN SITU COLORATION COMPOSITION HFC Prestige International Holding Switzerland S.a.r.l. (CH) 2021-10-13 — — EP disclosed
US-20210290519-A1 MULTICOMPONENT SILICONE COMPOSITION WELLA INT OPERATIONS SWITZERLAND SARL (CH) 2021-09-23 — — US disclosed
US-20210290518-A1 MULTICOMPONENT COMPOSITION HFC PRESTIGE INTERNATIONAL OPERATIONS SWITZERLAND SARL (CH) 2021-09-23 — — US disclosed
US-20210145726-A1 BICOMPONENT COMPOSITION HFC PRESTIGE INTERNATIONAL OPERATIONS SWITZERLAND SÀRL (CH) 2021-05-20 — — US disclosed
EP-3817825-A1 MULTICOMPONENT PUR COMPOSITION HFC Prestige International Holding Switzerland S.a.r.l. (CH) 2021-05-12 — — EP disclosed
EP-3787753-A1 MULTICOMPONENT COMPOSITION HFC Prestige International Holding Switzerland S.a.r.l. (CH) 2021-03-10 — — EP disclosed
EP-3773922-A1 BICOMPONENT COMPOSITION HFC Prestige International Holding Switzerland S.a.r.l. (CH) 2021-02-17 — — EP disclosed
US-20200319569-A1 MAGENTA TONER ZEON CORPORATION (JP) 2020-10-08 — — US disclosed
US-10732533-B2 Magenta toner ZEON CORPORATION (JP) 2020-08-04 — — US disclosed
WO-2020114647-A1 MULTICOMPONENT IN SITU COLORATION COMPOSITION HFC PRESTIGE INTERNATIONAL HOLDING SWITZERLAND S.A.R.L (CH) 2020-06-11 — — WO disclosed
WO-2020007510-A1 MULTICOMPONENT PUR COMPOSITION HFC PRESTIGE INTERNATIONAL HOLDING SWITZERLAND S.A.R.L (CH) 2020-01-09 — — WO disclosed
WO-2019192916-A1 BICOMPONENT COMPOSITION HFC PRESTIGE INTERNATIONAL HOLDING SWITZERLAND S.A.R.L (CH) 2019-10-10 — — WO disclosed
US-20190243268-A1 MAGENTA TONER ZEON CORPORATION (JP) 2019-08-08 — — US disclosed
EP-3492986-A1 MAGENTA TONER Zeon Corporation (JP) 2019-06-05 — — EP 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 (7 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-20220016017-A1 COLOR COATINGS WITH DOWNSTREAM FEATURES KRT18, ITGA5, FLNA MEN1 2431/4885KMT2A 586/4885SETD7 741/4885
US-20230310300-A1 HAIR COLOURING COMPOSITIONS COMPRISING A BIO-BASED POLYMER AND A CROSSLINKER KRT18, MKI67, IK MEN1 811/4885KMT2A 876/4885SETD7 99/4885
US-20210290519-A1 MULTICOMPONENT SILICONE COMPOSITION CUTA, CD99, PLOD3 MEN1 10/4885KMT2A 648/4885SETD7 49/4885
US-20220054392-A1 MULTICOMPONENT IN SITU COLORATION COMPOSITION KRT18, PRKDC, VIM MEN1 1309/4885KMT2A 1653/4885SETD7 238/4885
US-11324688-B2 Bicomponent composition KRT18, EXOSC10, EXOSC9 MEN1 1869/4885KMT2A 1253/4885SETD7 822/4885
US-20210290518-A1 MULTICOMPONENT COMPOSITION KRT18, INCENP, IK MEN1 585/4885KMT2A 684/4885SETD7 473/4885
US-20210145726-A1 BICOMPONENT COMPOSITION KRT18, EXOSC10, EXOSC9 MEN1 1869/4885KMT2A 1253/4885SETD7 822/4885

“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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