SCHEMBL7741833

SCHEMBL7741833

CN(CO)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.47
CA2 P00918 2/20 0.47
CA9 Q16790 2/20 0.47
TAAR1 Q96RJ0 2/20 0.46
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
HTT P42858 1/20 0.42
FAAH O00519 1/20 0.41
PHGDH O43175 1/20 0.41
MGLL Q99685 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GLA P06280 1/20 0.41
TSHR P16473 1/20 0.41
CA1 P00915 1/20 0.41
NLRP3 Q96P20 1/20 0.41
L3MBTL1 Q9Y468 3/20 0.40
LMNA P02545 1/20 0.40
KDM4E B2RXH2 1/20 0.40
CRHBP P24387 1/20 0.40
CRHR2 Q13324 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
SCHEMBL20120105 0.86 ALDH1A1 (0.48) TAAR1ALDH1A1L3MBTL1KDM4E
SCHEMBL56003 0.80 L3MBTL1 (0.57) CA12CA2CA9TAAR1MEN1
SCHEMBL196635 0.78 KMT2A (0.49) CA12CA2CA9TAAR1MEN1
SCHEMBL1547824 0.78 KMT2A (0.49) CA12CA2CA9TAAR1MEN1
SCHEMBL2201285 0.78 CA12 (0.50) CA12CA2CA9TAAR1MEN1
SCHEMBL5928168 0.78 KDM4E (0.44) TAAR1MEN1KMT2AHTTALDH1A1
SCHEMBL11044440 0.78 CA12 (0.50) CA12CA2CA9TAAR1MEN1
SCHEMBL26081358 0.77 ALDH1A1 (0.52) HTTALDH1A1TSHRKDM4E
SCHEMBL11973878 0.77 KMT2A (0.47) CA12CA2CA9TAAR1MEN1
SCHEMBL11973371 0.77 KMT2A (0.47) CA12CA2CA9TAAR1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0520226-B2 Halogen scavenger composition ST CHEMICAL CO LTD (JP) 2000-10-11 EP claimed
EP-2989096-B1 SUBSTITUTED 5-(3,5-DIMETHYLISOXAZOL-4-YL)INDOLINE-2-ONES BEIGENE LTD (KY) 2019-04-10 EP disclosed
CN-105102452-B The ketones derivant of 5 (base of 3,5 dimethyl isoxazole 4) indoline 2 of substitution 百济神州有限公司 2018-01-26 CN disclosed
CN-103124717-B The method that selectivity obtains N methyl paraphenetidines 创新企业泰克诺普阮姆有限责任公司 2018-01-02 CN disclosed
US-9827226-B2 Substituted 5-(3,5-dimethylisoxazol-4-yl)indoline-2-ones BEIGENE, LTD. (KY) 2017-11-28 US disclosed
US-20170027912-A1 SUBSTITUTED 5-(3,5-DIMETHYLISOXAZOL-4-YL)INDOLINE-2-ONES BEONE MEDICINES I GMBH (CH) 2017-02-02 US disclosed
EP-2989096-A1 SUBSTITUTED5-(3,5-DIMETHYLISOXAZOL-4-YL)INDOLINE-2-ONES BeiGene, Ltd. (KY) 2016-03-02 EP disclosed
WO-2014173241-A1 SUBSTITUTED5-(3,5-DIMETHYLISOXAZOL-4-YL)INDOLINE-2-ONES BEIGENE, LTD. (GB) 2014-10-30 WO disclosed
US-6423799-B1 IRRADIATION BAYER AG (DE) 2002-07-23 US disclosed
US-5190640-A Sweetening sour oils and gases BAKER HUGHES INCORPORATED (US) 1993-03-02 US disclosed
US-4786595-A HYDROPHILIC BINDER WITH NONIONIC SURFACTANT, MEDICAL DIAGNOSIS FUJI PHOTO FILM CO., LTD. (JP) 1988-11-22 US disclosed
US-4503145-A DIAGNOSIS OF LIVER DISORDERS FUJI PHOTO FILM CO., LTD. (JP) 1985-03-05 US disclosed
US-4478942-A CATIONIC DYE BOUND TO ANIONIC POLYMER FOR ASSAY OF HYDROGEN PEROXIDE FUJI PHOTO FILM CO., LTD. (JP) 1984-10-23 US disclosed
US-4418037-A PYROGALLOL DERIVATIVE STORAGE STABILIZER FUJI PHOTO FILM CO., LTD. (JP) 1983-11-29 US disclosed
US-4062893-A SULFURIC ACID CATALYST NEW JAPAN CHEMICAL COMPANY, LIMITED (JA) 1977-12-13 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-20170027912-A1 SUBSTITUTED 5-(3,5-DIMETHYLISOXAZOL-4-YL)INDOLINE-2-ONES BRD4, BRPF3, BRD3 CA12 4752/4885CA2 4458/4885CA9 4597/4885

“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.