SCHEMBL5404445

SCHEMBL5404445

CCOc1cccc(C)c1N

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.55
CD44 P16070 1/20 0.46
MAPT P10636 6/20 0.42
L3MBTL1 Q9Y468 6/20 0.42
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
KDM4E B2RXH2 4/20 0.42
POLB P06746 2/20 0.42
TP53 P04637 1/20 0.42
CYP3A4 P08684 1/20 0.42
HPGD P15428 1/20 0.42
MAPK1 P28482 1/20 0.42
HSD17B10 Q99714 1/20 0.42
TDP1 Q9NUW8 2/20 0.42
PABPC1 P11940 1/20 0.42
GRK6 P43250 1/20 0.42
GAA P10253 2/20 0.41
LMNA P02545 1/20 0.41
RECQL P46063 1/20 0.41
NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL7930788 0.87 ALDH1A1 (0.64) ALDH1A1MAPTL3MBTL1MEN1KMT2A
SCHEMBL21694311 0.85 CD44 (0.48) ALDH1A1CD44MAPTCYP3A4LMNA
SCHEMBL23493021 0.85 CD44 (0.48) ALDH1A1CD44MAPTKDM4ETDP1
SCHEMBL11703860 0.84 MCHR1 (0.50) ALDH1A1CD44MAPTMEN1KMT2A
SCHEMBL21694326 0.83 CD44 (0.46) ALDH1A1CD44MAPTMEN1KMT2A
SCHEMBL23493037 0.83 CD44 (0.46) ALDH1A1CD44MAPTMEN1KMT2A
SCHEMBL11800324 0.82 CYP1A2 (0.59) CD44MAPTMEN1KMT2ACYP3A4
SCHEMBL23493027 0.82 ALDH1A1 (0.46) ALDH1A1CD44MAPTMEN1KMT2A
SCHEMBL23493036 0.82 ALDH1A1 (0.46) ALDH1A1CD44MAPTMEN1KMT2A
SCHEMBL23493024 0.82 ALDH1A1 (0.46) ALDH1A1CD44MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117136061-A SIK inhibitors and methods of use thereof 索尔特戈公司 2023-11-28 CN disclosed
US-20230265099-A1 SIK INHIBITORS AND METHODS OF USE THEREOF SOLTEGO, INC. (US) 2023-08-24 US disclosed
EP-4213851-A1 SIK INHIBITORS AND METHODS OF USE THEREOF Soltego, Inc. (US) 2023-07-26 EP disclosed
WO-2022166920-A1 PYRROLOPYRIDAZINE COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF 杭州中美华东制药有限公司 2022-08-11 WO disclosed
WO-2022061312-A1 SIK INHIBITORS AND METHODS OF USE THEREOF SOLTEGO, INC. (US) 2022-03-24 WO disclosed
CN-111718332-B 2-substituted pyrazol amino-4-substituted amino-5-pyrimidine formamide compound, composition and application thereof 北京赛特明强医药科技有限公司 2021-08-17 CN disclosed
CN-111718332-A 2-substituted pyrazol amino-4-substituted amino-5-pyrimidine formamide compound, composition and application thereof 北京赛特明强医药科技有限公司 2020-09-29 CN disclosed
WO-2020187292-A1 2-SUBSTITUTED PYRAZOLEAMINO-4-SUBSTITUTED AMINO-5-PYRIMIDINE FORMAMIDE COMPOUND, COMPOSITION AND USE THEREOF 北京赛特明强医药科技有限公司 2020-09-24 WO disclosed
WO-2020032090-A1 EPOXY COMPOUND, EPOXY RESIN, EPOXY RESIN COMPOSITION, CURED RESIN PRODUCT, PREPREG, FIBER-REINFORCED COMPOSITE MATERIAL, AND PRODUCTION METHOD FOR THESE 帝人株式会社 2020-02-13 WO disclosed
EP-2808320-B1 Triphenylamine derivative, method for manufacturing the same, and electrophotographic photosensitive member KYOCERA DOCUMENT SOLUTIONS INC (JP) 2020-02-12 EP disclosed
US-4203920-A ANTIDIARRHEAL WILLIAM H. RORER, INC. (US) 1980-05-20 US disclosed
US-4147804-A ANTIARRHYTHMIA AGENTS WILLIAM H. RORER, INC. (US) 1979-04-03 US disclosed
US-4141718-A ANTIGROWTH AGENTS FOR PLANTS CIBA-GEIGY CORPORATION (US) 1979-02-27 US disclosed
US-4060635-A Amidinoureas for treating diarrhea WILLIAM H. RORER, INC. (US) 1977-11-29 US disclosed
US-4012222-A Herbicidal compositions containing dioxolane substituted anilids and method therefor VELSICOL CHEMICAL CORPORATION (US) 1977-03-15 US disclosed
US-3983174-A HERBICIDES VELSICOL CHEMICAL CORPORATION (US) 1976-09-28 US disclosed
US-3948950-A HERBICIDES VELSICOL CHEMICAL CORPORATION (US) 1976-04-06 US disclosed
US-3946045-A HERBICIDES VELSICOL CHEMICAL CORPORATION (US) 1976-03-23 US disclosed
US-3942972-A Dioxolane substituted α-haloanilides as herbicides VELSICOL CHEMICAL CORPORATION (US) 1976-03-09 US disclosed
US-3940259-A Dioxane substituted-α-haloanilides as herbicides VELSICOL CHEMICAL CORPORATION (US) 1976-02-24 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 (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-20230265099-A1 SIK INHIBITORS AND METHODS OF USE THEREOF SIK2, SIK1, SIK3 ALDH1A1 4493/4885CD44 2227/4885MAPT 2172/4885

“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.