SCHEMBL1133352

SCHEMBL1133352

c1ccc(Nc2ncc3ccccc3n2)nc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
MAPK10 P53779 1/20 0.48
GFER P55789 1/20 0.48
CCND3 P30281 3/20 0.48
CCNA2 P20248 3/20 0.48
CDK2 P24941 3/20 0.48
CCNK O75909 1/20 0.48
CDK9 P50750 1/20 0.48
CDK6 Q00534 1/20 0.48
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
ALDH1A1 P00352 2/20 0.47
ALOX15 P16050 2/20 0.47
HPGD P15428 1/20 0.47
CDK4 P11802 3/20 0.46
CCND1 P24385 3/20 0.46
CCND2 P30279 2/20 0.46
CCNA1 P78396 2/20 0.46

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
SCHEMBL6323476 0.85 MEN1 (0.47) KMT2AMEN1MAPK10GFERCCND3
SCHEMBL6467426 0.83 MAP3K5 (0.54) CDK2SMN1; SMN2ALDH1A1HPGDMAP3K5
SCHEMBL5496713 0.82 CCND3 (0.46) KMT2AMEN1MAPK10GFERCCND3
SCHEMBL6402766 0.81 KMT2A (0.47) KMT2AMEN1MAPK10GFERCCND3
SCHEMBL27770482 0.77 MAP3K5 (0.60) KMT2AMEN1CCND3CDK2NPC1
SCHEMBL31381352 0.77 MAP3K5 (0.60) KMT2AMEN1CCND3CDK2NPC1
Benzene SCHEMBL28188863 0.77 MAP3K5 (0.60) KMT2AMEN1CCND3CDK2NPC1
SCHEMBL167891 0.77 MAP3K5 (0.60) KMT2AMEN1CCND3CDK2NPC1
SCHEMBL1883319 0.76 KMT2A (0.57) KMT2AMEN1MAPK10GFERCCND3
SCHEMBL165738 0.76 ROCK1 (0.45) KMT2AMEN1CDK2SMN1; SMN2CDK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021216754-A1 USE OF P38 MAPK INHIBITORS FOR PREVENTION AND TREATMENT OF AGING AND AGING-RELATED DISORDERS AND FOR BOOSTING AN IMMUNE SYSTEM Spring Discovery, Inc. (US) 2021-10-28 WO claimed
EP-2286804-A1 A method of treating degenerative disc disease DePuy Spine, Inc. (US) 2011-02-23 EP claimed
US-20090162376-A1 Trans-capsular administration of p38 map kinase inhibitors into orthopedic joints DEPUY MITEK, LLC 2009-06-25 US claimed
US-20090162351-A1 Transdiscal administration of inhibitors of p38 MAP kinase DEPUY SPINE, INC. (US) 2009-06-25 US claimed
JP-2007502327-A 2007-02-08 JP claimed
CN-1822824-A Methods of treating degenerative disc disease DEPUY SPINE INC (US) 2006-08-23 CN claimed
EP-1675589-A2 TREATMENT OF INFLAMED JOINTS DePuy Spine, Inc. (US) 2006-07-05 EP claimed
EP-1631266-A2 A METHOD OF TREATING DEGENERATIVE DISC DISEASE DePuy Spine, Inc. (US) 2006-03-08 EP claimed
WO-2005011689-A2 TREATMENT OF INFLAMED JOINTS DEPUY SPINE, INC. (US) 2005-02-10 WO claimed
US-20050025765-A1 Trans-capsular administration of high specificity cytokine inhibitors into orthopedic joints DEPUY SPINE, INC. (US) 2005-02-03 US claimed
WO-2005000283-A2 A METHOD OF TREATING DEGENERATIVE DISC DISEASE DEPUY SPINE, INC. (US) 2005-01-06 WO claimed
US-20040229878-A1 Transdiscal administration of specific inhibitors of P38 kinase DEPUY SPINE, INC. (US) 2004-11-18 US claimed
US-RE49219-E1 Local intraosseous administration of bone forming agents and anti-resorptive agents, and devices therefor DePuy Synthes Products, Inc. (US) 2022-09-27 US disclosed
WO-2021216754-A1 USE OF P38 MAPK INHIBITORS FOR PREVENTION AND TREATMENT OF AGING AND AGING-RELATED DISORDERS AND FOR BOOSTING AN IMMUNE SYSTEM Spring Discovery, Inc. (US) 2021-10-28 WO disclosed
US-8986696-B2 Trans-capsular administration of p38 map kinase inhibitors into orthopedic joints DEPUY MITEK, INC. (US) 2015-03-24 US disclosed
US-8895540-B2 Local intraosseous administration of bone forming agents and anti-resorptive agents, and devices therefor DePuy Synthes Products, LLC (US) 2014-11-25 US disclosed
WO-2005011689-A2 TREATMENT OF INFLAMED JOINTS DEPUY SPINE, INC. (US) 2005-02-10 WO disclosed
US-20050025765-A1 Trans-capsular administration of high specificity cytokine inhibitors into orthopedic joints DEPUY SPINE, INC. (US) 2005-02-03 US disclosed
WO-2005000283-A2 A METHOD OF TREATING DEGENERATIVE DISC DISEASE DEPUY SPINE, INC. (US) 2005-01-06 WO disclosed
US-20040229878-A1 Transdiscal administration of specific inhibitors of P38 kinase DEPUY SPINE, INC. (US) 2004-11-18 US disclosed