SCHEMBL222895

SCHEMBL222895

Nc1cccc(C(N)(c2ccccc2)c2ccccc2)c1N

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 3/20 0.53
CD44 P16070 1/20 0.37
CYP3A4 P08684 4/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
ALOX15 P16050 1/20 0.36
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36
TSHR P16473 5/20 0.36
PIK3CA P42336 1/20 0.36
ALDH1A1 P00352 6/20 0.32
HSD17B10 Q99714 3/20 0.32
HPGD P15428 2/20 0.32
KEAP1 Q14145 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
KIF11 P52732 2/20 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
Hydrochloric Acid SCHEMBL27897779 0.98 KCNN4 (0.52) KCNN4CD44CYP3A4SMN1; SMN2ALOX15
SCHEMBL3132847 0.85 KCNN4 (0.42) KCNN4CD44CYP3A4SMN1; SMN2ALOX15
SCHEMBL572998 0.85 KCNN4 (0.59) KCNN4CYP3A4SMN1; SMN2ALOX15CASP1
SCHEMBL4856433 0.84 HPGD (0.46) KCNN4CYP3A4SMN1; SMN2CASP1CASP7
SCHEMBL7584160 0.83 KCNN4 (0.52) KCNN4CYP3A4SMN1; SMN2ALOX15CASP1
Pyrazole SCHEMBL28118141 0.83 KCNN4 (0.39) KCNN4
SCHEMBL10784751 0.81 CD44 (0.38) KCNN4CD44CYP3A4SMN1; SMN2ALOX15
SCHEMBL2302240 0.80 CD44 (0.39) KCNN4CD44CYP3A4SMN1; SMN2ALOX15
SCHEMBL4409081 0.78 CYP3A4 (0.41) KCNN4CD44CYP3A4SMN1; SMN2ALOX15
SCHEMBL11613116 0.78 TSHR (0.39) KCNN4CD44CYP3A4SMN1; SMN2ALOX15

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 801 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117924096-A Method for synthesizing 4, 4'' -triamino triphenylmethane 北京理工大学 2024-04-26 CN claimed
CN-111454413-B Multifunctional polyaspartic acid ester mixture and preparation method and application thereof 万华化学集团股份有限公司 2022-02-18 CN claimed
WO-2020158619-A1 HAIR DYE COMPOSITION AND HAIR DYEING METHOD ホーユー株式会社 2020-08-06 WO claimed
CN-110330788-A A kind of conductive and heat-conductive polyamide high molecular material 太仓金凯特新材料科技有限公司 2019-10-15 CN claimed
CN-110317449-A A kind of preparation method of selfreparing polyamide electroconductive high molecular material 太仓金凯特新材料科技有限公司 2019-10-11 CN claimed
CN-109880089-A Poly- naphthalimide catalysis material of a kind of wide spectrum response and preparation method thereof 四川大学 2019-06-14 CN claimed
CN-108948391-A A kind of Kapton and preparation method thereof 吉林大学 2018-12-07 CN claimed
CN-106336654-B A kind of heat conduction polyamide material 温州市赢创新材料技术有限公司 2018-09-11 CN claimed
CN-108039461-A A kind of silicium cathode material of coated and preparation method thereof 西交利物浦大学 2018-05-15 CN claimed
CN-107644996-A A kind of preparation method of pure organic polymer lithium ion battery electrode material 曲靖师范学院 2018-01-30 CN claimed
CN-101709209-A Preparation method of environment-friendly polymeric isocyanate glue LIAONING HONGSHAN CHEMICAL CO 2010-05-19 CN claimed
US-7338535-B2 Process for rapid dyeing and rapid decoloration of human keratin fibres with certain direct dyes L'OREAL S.A. (FR) 2008-03-04 US claimed
EP-1415643-A1 Process for rapidly colouring and decouring human keratinic fibres with direct dyes L'OREAL (FR) 2004-05-06 EP claimed
US-20040078906-A1 Process for rapid dyeing and rapid decoloration of human keratin fibres with certain direct dyes L'OREAL S.A. (FR) 2004-04-29 US claimed
EP-0872772-B1 Toner, developer, and process for producing the same SHARP KK (JP) 2002-10-23 EP claimed
EP-0717080-B1 Method for the preparation of triphenylmethan colorants CLARIANT GMBH (DE) 2001-10-17 EP claimed
EP-0931280-B1 ELECTROPHOTOGRAPHIC CARRIER COMPOSITIONS HAVING IMPROVED LIFE NASHUA CORP (US) 2000-08-02 EP claimed
EP-0872772-A1 Toner, developer, and process for producing the same Sharp Kabushiki Kaisha (JP) 1998-10-21 EP claimed
US-5808116-A Process for the preparation of triphenylemethane coloring agents HOECHST AKTIENGESELLSCHAFT (DE) 1998-09-15 US claimed
CN-1133862-A Process for preparation of triphenylmethane coloring agents HOECHST AG (DE) 1996-10-23 CN claimed

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-20040078906-A1 Process for rapid dyeing and rapid decoloration of human keratin fibres with certain direct dyes KRT18, CYBA, TYR KCNN4 895/4885CD44 961/4885CYP3A4 835/4885

“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.