Sugi Predict

Sugi Predict / Compounds / SCHEMBL18066434

SCHEMBL18066434

SCHEMBL18066434

Fc1ccc(N=Nc2ncc[nH]2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 8/20 0.58
▸ KMT2A Q03164 8/20 0.58
▸ RAB9A P51151 6/20 0.58
▸ NPC1 O15118 3/20 0.58
▸ HSP90AA1 P07900 1/20 0.58
▸ AGTR1 P30556 1/20 0.58
▸ MAPT P10636 7/20 0.41
▸ L3MBTL1 Q9Y468 3/20 0.41
▸ GFER P55789 1/20 0.41
▸ MAPK1 P28482 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ TDP1 Q9NUW8 2/20 0.36
▸ ALOX12 P18054 1/20 0.36
▸ USP2 O75604 1/20 0.35
▸ DNMT1 P26358 1/20 0.35
▸ CASP3 P42574 1/20 0.35
▸ SENP8 Q96LD8 1/20 0.35

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
SCHEMBL14606324 1.00 MEN1 (0.58) MEN1KMT2ARAB9ANPC1HSP90AA1
SCHEMBL11609544 0.81 MEN1 (0.58) MEN1KMT2ARAB9ANPC1HSP90AA1
SCHEMBL11609547 0.81 MEN1 (0.58) MEN1KMT2ARAB9ANPC1HSP90AA1
SCHEMBL13201267 0.81 NPC1 (0.58) MEN1KMT2ARAB9ANPC1HSP90AA1
SCHEMBL6933089 0.81 MEN1 (0.58) MEN1KMT2ARAB9ANPC1HSP90AA1
SCHEMBL6933093 0.81 MEN1 (0.58) MEN1KMT2ARAB9ANPC1HSP90AA1
SCHEMBL3069084 0.80 KMT2A (0.57) MEN1KMT2ARAB9ANPC1HSP90AA1
SCHEMBL3069082 0.80 KMT2A (0.57) MEN1KMT2ARAB9ANPC1HSP90AA1
SCHEMBL11107953 0.78 MEN1 (0.52) MEN1KMT2ARAB9ANPC1HSP90AA1
SCHEMBL11103862 0.78 MEN1 (0.52) MEN1KMT2ARAB9ANPC1HSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3271423-B1 CATIONIC DIRECT DYES BASF SE (DE) 2022-08-31 — — EP disclosed
CN-107428709-B Cationic direct dyes 巴斯夫欧洲公司 2021-10-08 — — CN disclosed
US-20180244924-A1 Cationic Direct Dyes BASF SE (DE) 2018-08-30 — — US disclosed
US-20180078479-A1 METHOD OF COLORING HAIR WITH DIRECT DYE COMPOUNDS NOXELL CORPORATION 2018-03-22 — — US disclosed
US-20180071189-A1 COMPOSITIONS FOR DYEING HAIR WITH CATIONIC DIRECT DYES GALLERIA CO. 2018-03-15 — — US disclosed
CN-107750154-A Composition for dyeing hair using cationic direct dyes 诺赛尔股份有限公司 2018-03-02 — — CN disclosed
CN-107635538-A Use the method for direct dyes compound dyed hair 诺赛尔股份有限公司 2018-01-26 — — CN disclosed
EP-3271025-A1 METHOD OF COLORING HAIR WITH DIRECT DYE COMPOUNDS Noxell Corporation (US) 2018-01-24 — — EP disclosed
EP-3271423-A1 CATIONIC DIRECT DYES BASF SE (DE) 2018-01-24 — — EP disclosed
EP-3270874-A1 COMPOSITIONS FOR DYEING HAIR WITH CATIONIC DIRECT DYES Noxell Corporation (US) 2018-01-24 — — EP disclosed
US-9844501-B2 Compositions for dyeing hair with cationic direct dyes NOXELL CORPORATION (US) 2017-12-19 — — US disclosed
US-9839593-B2 Method of coloring hair with direct dye compounds NOXELL CORPORATION (US) 2017-12-12 — — US disclosed
CN-107428709-A Cation direct dye 巴斯夫欧洲公司 2017-12-01 — — CN disclosed
WO-2016146813-A1 CATIONIC DIRECT DYES BASF SE (DE) 2016-09-22 — — WO disclosed
WO-2016146813-A1 CATIONIC DIRECT DYES BASF SE (DE) 2016-09-22 — — WO disclosed
WO-2016149429-A1 COMPOSITIONS FOR DYEING HAIR WITH CATIONIC DIRECT DYES THE PROCTER & GAMBLE COMPANY (US) 2016-09-22 — — WO disclosed
WO-2016149431-A1 METHOD OF COLORING HAIR WITH DIRECT DYE COMPOUNDS THE PROCTER & GAMBLE COMPANY (US) 2016-09-22 — — WO disclosed
US-20160271041-A1 Method of Coloring Hair with Direct Dye Compounds DEUTSCHE BANK TRUST COMPANY AMERICAS, AS COLLATERAL AGENT 2016-09-22 — — US disclosed
US-20160271040-A1 Compositions for Dyeing Hair with Cationic Direct Dyes DEUTSCHE BANK TRUST COMPANY AMERICAS, AS COLLATERAL AGENT 2016-09-22 — — 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 (5 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-20180071189-A1 COMPOSITIONS FOR DYEING HAIR WITH CATIONIC DIRECT DYES SHH, TYR, NACA MEN1 1269/4885KMT2A 3174/4885RAB9A 2158/4885
US-20160271041-A1 Method of Coloring Hair with Direct Dye Compounds SHH, TYR, POLR1C MEN1 1641/4885KMT2A 3325/4885RAB9A 2728/4885
US-20160271040-A1 Compositions for Dyeing Hair with Cationic Direct Dyes SHH, TYR, NACA MEN1 1269/4885KMT2A 3174/4885RAB9A 2158/4885
US-20180244924-A1 Cationic Direct Dyes H1-0, TPH1, H1-2 MEN1 146/4885KMT2A 994/4885RAB9A 3559/4885
US-20180078479-A1 METHOD OF COLORING HAIR WITH DIRECT DYE COMPOUNDS SHH, TYR, POLR1C MEN1 1641/4885KMT2A 3325/4885RAB9A 2728/4885

“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.