SCHEMBL357003

SCHEMBL357003

Clc1nc2ncncc2[nH]1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.47
METAP1 P53582 1/20 0.47
NPY5R Q15761 1/20 0.35
KDM4E B2RXH2 1/20 0.34
HTT P42858 1/20 0.33
HSD17B10 Q99714 1/20 0.33
GRIN2B Q13224 2/20 0.32
RPS6KA5 O75582 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
ENPP1 P22413 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 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 SCHEMBL4982877 0.98 METAP2 (0.46) METAP2METAP1NPY5RKDM4EHTT
Purine SCHEMBL25254163 0.78 KDM4E (0.59) METAP2METAP1KDM4ERPS6KA5
SCHEMBL1963575 0.75 METAP2 (0.47) METAP2METAP1NPY5RENPP1
SCHEMBL277596 0.75 METAP2 (0.51) METAP2METAP1NPY5RGRIN2BENPP1
SCHEMBL2011131 0.75 METAP2 (0.47) METAP2METAP1NPY5RGRIN2BENPP1
SCHEMBL375955 0.75 SMN1; SMN2 (0.52) METAP2METAP1NPY5RHTTGRIN2B
SCHEMBL3801779 0.75 METAP2 (0.47) METAP2METAP1NPY5RHTTHSD17B10
SCHEMBL3894 0.75 METAP2 (0.47) METAP2METAP1NPY5RENPP1
SCHEMBL5632 0.75 NUDT1 (0.50) METAP2METAP1NPY5RKDM4EHSD17B10
SCHEMBL7787137 0.75 METAP2 (0.47) METAP2METAP1NPY5RENPP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112245440-A Use of tocotrienol derivatives 北京蔚蓝之源医药科技有限公司 2021-01-22 CN claimed
CN-108484605-A A kind of chloro- 9- of 2- amino -6-(4- acetoxy-3s-acetyl-o-methyl butyl)The preparation method of purine 上药康丽(常州)药业有限公司 2018-09-04 CN claimed
EP-2663309-B1 PROCESSES FOR PREPARING ISOQUINOLINONES AND SOLID FORMS OF ISOQUINOLINONES INFINITY PHARMACEUTICALS INC (US) 2017-03-15 EP claimed
CN-103648499-B Processes for preparing isoquinolinones and solid forms of isoquinolinones 无限药品股份有限公司 2017-02-15 CN claimed
US-9290497-B2 Processes for preparing isoquinolinones and solid forms of isoquinolinones INFINITY PHARMACEUTICALS, INC. (US) 2016-03-22 US claimed
CN-104031048-B A kind of β-chloroethylnitrosoureas compound and preparation method and use thereof BEIJING UNIVERSITY OF TECHNOLOGY (CN) 2016-03-09 CN claimed
CN-105294761-A Impurities of tenofovir disoproxil fumarate or tenofovir, and preparation method thereof ZHEJIANG JIUZHOU PHARMACEUTICAL TECHNOLOGY CO LTD 2016-02-03 CN claimed
US-20140371450-A1 PROCESSES FOR PREPARING ISOQUINOLINONES AND SOLID FORMS OF ISOQUINOLINONES HCR COLLATERAL MANAGEMENT, LLC 2014-12-18 US claimed
CN-104031048-A Novel beta-chloroethylnitrosourea compounds, and synthesis method and application thereof UNIV BEIJING TECHNOLOGY 2014-09-10 CN claimed
CN-101856313-B Association of monosaccharides and adenosine and its cosmetic use OREAL 2014-02-19 CN claimed
EP-1628685-A2 ANTIVIRAL PHOSPHONATE ANALOGS GILEAD SCIENCES, INC. (US) 2006-03-01 EP claimed
EP-1617848-A2 ANTI-CANCER PHOSPHONATE CONJUGATES GILEAD SCIENCES, INC. (US) 2006-01-25 EP claimed
WO-2005023811-A1 PROCESS FOR THE PREPARATION OF (1S, 4R) -CIS-4-‘2-AMINO-6CHLORO-9H-PURIN-9-YL!-2-CYCLOPENTENE-1-METHANOL GLAXO GROUP LIMITED (GB) 2005-03-17 WO claimed
WO-2004096286-A2 ANTIVIRAL PHOSPHONATE ANALOGS GILEAD SCIENCES, INC. (US) 2004-11-11 WO claimed
WO-2004096235-A2 ANTI-CANCER PHOSPHONATE ANALOGS GILEAD SCIENCES, INC. (US) 2004-11-11 WO claimed
EP-0861841-B1 PROCESS FOR PRODUCING 2-AMINO-6-IODOPURINE SUMIKA FINE CHEMICALS COMPANY (JP) 2001-04-04 EP claimed
US-5994541-A Process for producing 2-amino-6-iodopurine SUMIKA FINE CHEMICALS CO., LTD. (JP) 1999-11-30 US claimed
CN-1226602-A Fast culture media for mycobaterium tuberculosis and preparation thereof LIU ZHAOYUN (CN) 1999-08-25 CN claimed
EP-0861841-A1 PROCESS FOR PRODUCING 2-AMINO-6-IODOPURINE SUMIKA FINE CHEMICALS Company, Limited (JP) 1998-09-02 EP claimed
US-3939089-A PEROXYSULFATE TOKAI DENKA KOGYO KABUSHIKI KAISHA (JA) 1976-02-17 US 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-20140371450-A1 PROCESSES FOR PREPARING ISOQUINOLINONES AND SOLID FORMS OF ISOQUINOLINONES PIK3CA, PDPK1, AKT3 METAP2 4567/4885METAP1 4426/4885NPY5R 4020/4885

“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.