SCHEMBL17847610

SCHEMBL17847610

O=C1NCCc2[nH]cc(-c3ccc(F)cc3)c21

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPKAPK2 P49137 3/20 0.45
BUB1 O43683 1/20 0.43
PARP10 Q53GL7 2/20 0.43
PARP1 P09874 1/20 0.43
RIPK3 Q9Y572 10/20 0.42
GRM5 P41594 1/20 0.40
PARP11 Q9NR21 1/20 0.40
HSP90AA1 P07900 1/20 0.38
HSP90AB1 P08238 1/20 0.38
GRM2 Q14416 1/20 0.38
CDK2 P24941 1/20 0.38

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
SCHEMBL25207231 0.84 PARP10 (0.51) MAPKAPK2BUB1PARP10PARP1PARP11
SCHEMBL17847604 0.75 PKN2 (0.56) MAPKAPK2PARP10PARP1RIPK3PARP11
SCHEMBL17847644 0.73 BUB1 (0.49) MAPKAPK2BUB1PARP10PARP1RIPK3
SCHEMBL25211238 0.72 CDC7 (0.39) RIPK3HSP90AA1HSP90AB1GRM2
SCHEMBL25203499 0.72 POLB (0.38) BUB1
SCHEMBL798998 0.72 RIPK3 (0.44) MAPKAPK2BUB1PARP10PARP1RIPK3
SCHEMBL6110112 0.71 CDC7 (0.72) MAPKAPK2BUB1RIPK3
SCHEMBL17847590 0.70 RIPK3 (0.46) RIPK3HSP90AA1HSP90AB1GRM2
SCHEMBL155162 0.70 BUB1 (0.46) MAPKAPK2BUB1PARP10PARP1RIPK3
SCHEMBL30625735 0.68 CDC7 (0.40) MAPKAPK2BUB1PARP10PARP1PARP11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10301306-B2 Substituted dihydro-1H-pyrrolo[3,2-c]pyridin-4(5H)-ones as RIPK3 inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2019-05-28 US disclosed
US-10301306-B2 Substituted dihydro-1H-pyrrolo[3,2-c]pyridin-4(5H)-ones as RIPK3 inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2019-05-28 US disclosed
US-20170362219-A1 SUBSTITUTED DIHYDRO-1H-PYRROLO[3,2-C]PYRIDIN-4(5H)-ONES AS RIPK3 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2017-12-21 US disclosed
US-20170362219-A1 SUBSTITUTED DIHYDRO-1H-PYRROLO[3,2-C]PYRIDIN-4(5H)-ONES AS RIPK3 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2017-12-21 US disclosed
US-20170362219-A1 SUBSTITUTED DIHYDRO-1H-PYRROLO[3,2-C]PYRIDIN-4(5H)-ONES AS RIPK3 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2017-12-21 US disclosed
WO-2016100166-A1 SUBSTITUTED DIHYDRO-1H-PYRROLO[3,2-c]PYRIDIN-4(5H)-ONES AS RIPK3 INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2016-06-23 WO disclosed
WO-2016100166-A1 SUBSTITUTED DIHYDRO-1H-PYRROLO[3,2-c]PYRIDIN-4(5H)-ONES AS RIPK3 INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2016-06-23 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 (2 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-20170362219-A1 SUBSTITUTED DIHYDRO-1H-PYRROLO[3,2-C]PYRIDIN-4(5H)-ONES AS RIPK3 INHIBITORS RIPK3, RIPK1, RIPK4 MAPKAPK2 99/4885BUB1 479/4885PARP10 332/4885
US-10301306-B2 Substituted dihydro-1H-pyrrolo[3,2-c]pyridin-4(5H)-ones as RIPK3 inhibitors RIPK3, RIPK1, RIPK4 MAPKAPK2 99/4885BUB1 479/4885PARP10 332/4885

“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.