SCHEMBL4352565

SCHEMBL4352565

c1cc2c(ncc3cc[nH]c32)[nH]1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NUDT1 P36639 4/20 0.47
AXL P30530 4/20 0.47
PRKCI P41743 4/20 0.47
CDK8 P49336 2/20 0.42
MAPK1 P28482 2/20 0.41
PIK3CD O00329 1/20 0.41
PIK3CA P42336 1/20 0.41
PIK3CB P42338 1/20 0.41
PIK3CG P48736 1/20 0.41
RIPK1 Q13546 2/20 0.40
JAK2 O60674 2/20 0.38
AURKB Q96GD4 2/20 0.38
IKBKB O14920 1/20 0.38
CHUK O15111 1/20 0.38
DAPK3 O43293 1/20 0.38
PRKD3 O94806 1/20 0.38
MAP4K4 O95819 1/20 0.38
PAK4 O96013 1/20 0.38
CSF1R P07333 1/20 0.38
RET P07949 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
SCHEMBL2318359 0.79 CCNK (0.46) NUDT1AXLPRKCICDK8MAPK1
SCHEMBL14697441 0.76 CCR8 (0.52) NUDT1AXLPRKCIJAK2JAK3
SCHEMBL14697443 0.76 PRKCI (0.41) NUDT1AXLPRKCIMAPK1JAK2
SCHEMBL30381637 0.73 KDM4E (0.50) NUDT1AXLPRKCICDK8MAPK1
SCHEMBL12612679 0.73 PRKCI (0.46) NUDT1AXLPRKCICDK8MAPK1
SCHEMBL2223296 0.72 PRKCI (0.44) NUDT1AXLPRKCICDK8MAPK1
SCHEMBL455351 0.72 KDM4E (0.53) AHR
SCHEMBL12424590 0.71 PRKCI (0.47) NUDT1AXLPRKCIMAPK1JAK2
SCHEMBL29588119 0.71 PRKCI (0.47) NUDT1AXLPRKCIMAPK1JAK2
SCHEMBL28735162 0.71 PRKCI (0.40) NUDT1AXLPRKCIMAPK1JAK2

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
US-20230082167-A1 NOVEL TRICYCLIC COMPOUNDS ABBVIE INC (US) 2023-03-16 US disclosed
CN-115385911-A Compound with dipyrrolopyridine structure, preparation method and medical application 南京康屹生物医药中心(有限合伙) 2022-11-25 CN disclosed
US-20180291029-A1 NOVEL TRICYCLIC COMPOUNDS ABBVIE INC. (US) 2018-10-11 US disclosed
US-20160326181-A1 NOVEL TRICYCLIC COMPOUNDS ABBVIE INC. (US) 2016-11-10 US disclosed
EP-3031324-A2 TRICYCLIC KINASE INHIBITORS AbbVie Inc. (US) 2016-06-15 EP disclosed
US-9365579-B2 Tricyclic compounds ABBVIE INC. (US) 2016-06-14 US disclosed
EP-2299821-B1 TRICYCLIC COMPOUNDS ABBVIE INC (US) 2015-11-04 EP disclosed
US-20150210708-A1 NOVEL TRICYCLIC COMPOUNDS ABBVIE INC. (US) 2015-07-30 US disclosed
US-8962629-B2 Tricyclic compounds ABBVIE INC. (US) 2015-02-24 US disclosed
US-20090312338-A1 Novel Tricyclic Compounds ABBOTT LABORATORIES (US) 2009-12-17 US disclosed
US-20070191420-A1 Kinase inhibitors DEVGEN NV 2007-08-16 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 (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-20180291029-A1 NOVEL TRICYCLIC COMPOUNDS CYP11B2, CYP11B1, ABCB1 NUDT1 1598/4885AXL 3812/4885PRKCI 3201/4885
US-20090312338-A1 Novel Tricyclic Compounds CYP11B2, CYP11B1, ABCB1 NUDT1 1598/4885AXL 3812/4885PRKCI 3201/4885
US-20160326181-A1 NOVEL TRICYCLIC COMPOUNDS CYP11B2, CYP11B1, ABCB1 NUDT1 1598/4885AXL 3812/4885PRKCI 3201/4885
US-20150210708-A1 NOVEL TRICYCLIC COMPOUNDS CYP11B2, CYP11B1, ABCB1 NUDT1 1598/4885AXL 3812/4885PRKCI 3201/4885
US-20230082167-A1 NOVEL TRICYCLIC COMPOUNDS CYP11B2, CYP11B1, ABCB1 NUDT1 1598/4885AXL 3812/4885PRKCI 3201/4885
US-20070191420-A1 Kinase inhibitors ROCK1, ROCK2, MAP3K20 NUDT1 3875/4885AXL 673/4885PRKCI 113/4885

“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.