SCHEMBL2511848

SCHEMBL2511848

Nc1ccnn(-c2ccccc2)c1=O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.60
RAB9A P51151 6/20 0.47
SMN1; SMN2 Q16637 5/20 0.47
NPC1 O15118 5/20 0.47
MAPT P10636 4/20 0.47
ALDH1A1 P00352 4/20 0.47
NPSR1 Q6W5P4 4/20 0.47
HTT P42858 3/20 0.47
PAX8 Q06710 2/20 0.47
LMNA P02545 2/20 0.47
MITF O75030 2/20 0.47
S1PR4 O95977 1/20 0.47
THRB P10828 1/20 0.47
XBP1 P17861 1/20 0.47
S1PR1 P21453 1/20 0.47
RXFP1 Q9HBX9 1/20 0.47
GAA P10253 1/20 0.46
CYP2C9 P11712 8/20 0.44
CYP3A4 P08684 4/20 0.44
CYP2C19 P33261 4/20 0.44

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
SCHEMBL20687950 0.81 CYP17A1 (0.45) POLBRAB9ASMN1; SMN2NPC1ALDH1A1
SCHEMBL28391996 0.77 POLB (0.50) POLBRAB9ASMN1; SMN2NPC1MAPT
SCHEMBL10446383 0.77 RAB9A (0.61) POLBRAB9ASMN1; SMN2NPC1MAPT
SCHEMBL10941265 0.77 RAB9A (0.61) POLBRAB9ASMN1; SMN2NPC1MAPT
SCHEMBL433371 0.75 POLB (1.00) POLBRAB9ASMN1; SMN2NPC1MAPT
SCHEMBL5189021 0.75 RIPK2 (0.55) POLBRAB9ASMN1; SMN2NPC1MAPT
SCHEMBL5717721 0.74 MAPT (0.47) POLBRAB9ASMN1; SMN2NPC1MAPT
SCHEMBL30785500 0.74 ALDH1A1 (0.48) POLBRAB9ASMN1; SMN2NPC1MAPT
Pyrazon SCHEMBL1858918 0.73 RAB9A (0.70) POLBRAB9ASMN1; SMN2NPC1MAPT
SCHEMBL134480 0.73 RAB9A (0.70) POLBRAB9ASMN1; SMN2NPC1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10273237-B2 Imidazopyridazine compounds useful as modulators of IL-12, IL-23 and/or IFN-α responses BRISTOL-MYERS SQUIBB COMPANY (US) 2019-04-30 US disclosed
US-10273237-B2 Imidazopyridazine compounds useful as modulators of IL-12, IL-23 and/or IFN-α responses BRISTOL-MYERS SQUIBB COMPANY (US) 2019-04-30 US disclosed
EP-3080131-B1 IMIDAZOPYRIDAZINE COMPOUNDS USEFUL AS MODULATORS OF IL-12, IL-23 AND/OR IFN ALPHA RESPONSES BRISTOL MYERS SQUIBB CO (US) 2018-10-10 EP disclosed
US-20160304524-A1 IMIDAZOPYRIDAZINE COMPOUNDS USEFUL AS MODULATORS OF IL-12, IL-23 AND/OR IFN-ALPHA RESPONSES BRISTOL MYERS SQUIBB CO (US) 2016-10-20 US disclosed
US-20160304524-A1 IMIDAZOPYRIDAZINE COMPOUNDS USEFUL AS MODULATORS OF IL-12, IL-23 AND/OR IFN-ALPHA RESPONSES BRISTOL MYERS SQUIBB CO (US) 2016-10-20 US disclosed
US-20160304524-A1 IMIDAZOPYRIDAZINE COMPOUNDS USEFUL AS MODULATORS OF IL-12, IL-23 AND/OR IFN-ALPHA RESPONSES BRISTOL MYERS SQUIBB CO (US) 2016-10-20 US disclosed
EP-3080131-A1 IMIDAZOPYRIDAZINE COMPOUNDS USEFUL AS MODULATORS OF IL-12, IL-23 AND/OR IFN ALPHA RESPONSES Bristol-Myers Squibb Company (US) 2016-10-19 EP disclosed
CN-105992768-A Imidazopyridazine compounds useful as modulators of il-12, il-23 and/or ifn alpha responses 百时美施贵宝公司 2016-10-05 CN disclosed
WO-2015089143-A1 IMIDAZOPYRIDAZINE COMPOUNDS USEFUL AS MODULATORS OF IL-12, IL-23 AND/OR IFN ALPHA RESPONSES BRISTOL-MYERS SQUIBB COMPANY (US) 2015-06-18 WO disclosed
WO-2015089143-A1 IMIDAZOPYRIDAZINE COMPOUNDS USEFUL AS MODULATORS OF IL-12, IL-23 AND/OR IFN ALPHA RESPONSES BRISTOL-MYERS SQUIBB COMPANY (US) 2015-06-18 WO disclosed
WO-2014091265-A1 PYRIMIDINE-2,4-DIAMINE DERIVATIVES AS KINASE INHIBITORS AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2014-06-19 WO disclosed
US-20110224128-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF MUSCULAR DYSTROPHY WHALEN ANNE 2011-09-15 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 (3 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-20110224128-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF MUSCULAR DYSTROPHY PYGM, TNNC1, MYOF POLB 165/4885RAB9A 3859/4885SMN1; SMN2 6/4885
US-20160304524-A1 IMIDAZOPYRIDAZINE COMPOUNDS USEFUL AS MODULATORS OF IL-12, IL-23 AND/OR IFN-ALPHA RESPONSES TYK2, IFNAR1, JAK3 POLB 2551/4885RAB9A 2405/4885SMN1; SMN2 4093/4885
US-10273237-B2 Imidazopyridazine compounds useful as modulators of IL-12, IL-23 and/or IFN-α responses TYK2, IFNG, IFNAR1 POLB 2672/4885RAB9A 2273/4885SMN1; SMN2 4179/4885

“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.