SCHEMBL17801253

SCHEMBL17801253

COC(CBr)CN1C(=O)c2ccccc2C1=O

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.47
ALDH1A1 P00352 5/20 0.44
MAPT P10636 3/20 0.43
CASP3 P42574 1/20 0.43
DRD3 P35462 1/20 0.42
MAPK1 P28482 1/20 0.42
RAB9A P51151 3/20 0.42
HPGD P15428 2/20 0.42
NPC1 O15118 1/20 0.42
TSHR P16473 1/20 0.42
PLIN1 O60240 1/20 0.42
ALOX15 P16050 1/20 0.42
PLIN5 Q00G26 1/20 0.42
ABHD5 Q8WTS1 1/20 0.42
RPS6KA2 Q15349 1/20 0.41

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
SCHEMBL18651719 0.85 KMT2A (0.48) KMT2AALDH1A1MAPTCASP3DRD3
SCHEMBL17127742 0.83 KMT2A (0.50) KMT2AALDH1A1MAPTCASP3MAPK1
SCHEMBL31284913 0.83 KMT2A (0.50) KMT2AALDH1A1MAPTCASP3MAPK1
SCHEMBL5795257 0.81 ALDH1A1 (0.47) KMT2AALDH1A1MAPTMAPK1RAB9A
SCHEMBL5796319 0.81 ALDH1A1 (0.47) KMT2AALDH1A1MAPTMAPK1RAB9A
SCHEMBL4760445 0.81 KMT2A (0.45) KMT2AALDH1A1MAPTCASP3MAPK1
SCHEMBL13416394 0.79 KMT2A (0.51) KMT2AALDH1A1MAPTCASP3MAPK1
SCHEMBL15796035 0.78 KMT2A (0.39) KMT2AALDH1A1MAPTCASP3DRD3
SCHEMBL2599263 0.77 ALDH1A1 (0.47) KMT2AALDH1A1MAPTCASP3DRD3
SCHEMBL14318320 0.77 ALDH1A1 (0.47) KMT2AALDH1A1MAPTCASP3DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3878451-A1 PHARMACEUTICAL COMPOSITION COMPRISING A JAK-INHIBITING 4,6-SUBSTITUTED-PYRAZOLO[1,5-A]PYRAZINE COMPOUND Array Biopharma Inc. (US) 2021-09-15 EP disclosed
US-11028093-B2 4,6-substituted-pyrazolo[1,5-a]pyrazines as janus kinase inhibitors ARRAY BIOPHARMA INC. (US) 2021-06-08 US disclosed
EP-3227297-B1 4,6-SUBSTITUTED-PYRAZOLO[1,5-A]PYRAZINES AS JANUS KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2021-01-20 EP disclosed
US-20200291039-A1 4,6-SUBSTITUTED-PYRAZOLO[1,5-a]PYRAZINES AS JANUS KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2020-09-17 US disclosed
US-10730880-B2 4,6-substituted-pyrazolo[1,5-a]pyrazines as Janus kinase inhibitors ARRAY BIOPHARMA INC. (US) 2020-08-04 US disclosed
CN-107278203-B 4, 6-substituted pyrazolo [1,5-a ] pyrazines as JANUS kinase inhibitors 阵列生物制药公司 2020-05-19 CN disclosed
US-20190177328-A1 4,6-SUBSTITUTED-PYRAZOLO[1,5-a]PYRAZINES AS JANUS KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2019-06-13 US disclosed
US-10189845-B2 4,6-substituted-pyrazolo[1,5-a]pyrazines as janus kinase inhibitors ARRAY BIOPHARMA INC. (US) 2019-01-29 US disclosed
US-20170362240-A1 4,6-SUBSTITUTED-PYRAZOLO[1,5-a]PYRAZINES AS JANUS KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2017-12-21 US disclosed
EP-3227297-A1 4,6-SUBSTITUTED-PYRAZOLO[1,5-a]PYRAZINES AS JANUS KINASE INHIBITORS Array Biopharma, Inc. (US) 2017-10-11 EP disclosed
WO-2016090285-A1 4,6-SUBSTITUTED-PYRAZOLO[1,5-a]PYRAZINES AS JANUS KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2016-06-09 WO 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 (6 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-20200291039-A1 4,6-SUBSTITUTED-PYRAZOLO[1,5-a]PYRAZINES AS JANUS KINASE INHIBITORS JAK1, JAK3, JAK2 KMT2A 1105/4885ALDH1A1 1526/4885MAPT 4210/4885
US-10730880-B2 4,6-substituted-pyrazolo[1,5-a]pyrazines as Janus kinase inhibitors JAK1, JAK3, JAK2 KMT2A 1105/4885ALDH1A1 1526/4885MAPT 4210/4885
US-20190177328-A1 4,6-SUBSTITUTED-PYRAZOLO[1,5-a]PYRAZINES AS JANUS KINASE INHIBITORS JAK1, JAK3, JAK2 KMT2A 1105/4885ALDH1A1 1526/4885MAPT 4210/4885
US-20170362240-A1 4,6-SUBSTITUTED-PYRAZOLO[1,5-a]PYRAZINES AS JANUS KINASE INHIBITORS JAK1, JAK3, JAK2 KMT2A 1105/4885ALDH1A1 1526/4885MAPT 4210/4885
US-10189845-B2 4,6-substituted-pyrazolo[1,5-a]pyrazines as janus kinase inhibitors JAK1, JAK3, JAK2 KMT2A 1105/4885ALDH1A1 1526/4885MAPT 4210/4885
US-11028093-B2 4,6-substituted-pyrazolo[1,5-a]pyrazines as janus kinase inhibitors JAK1, JAK3, JAK2 KMT2A 1105/4885ALDH1A1 1526/4885MAPT 4210/4885

“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.