SCHEMBL13633518

SCHEMBL13633518

CC(=O)Nc1cn2ccc(Br)cc2n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 2/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
PIK3CA P42336 10/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MAP3K5 Q99683 1/20 0.42
PIK3CG P48736 2/20 0.42
PIK3CD O00329 1/20 0.41
PIK3CB P42338 1/20 0.41
PIK3C3 Q8NEB9 1/20 0.41
PI4KB Q9UBF8 1/20 0.41
METTL3 Q86U44 2/20 0.41
MAPK13 O15264 1/20 0.40
BRAF P15056 1/20 0.40
KDR P35968 1/20 0.40
MAPK12 P53778 1/20 0.40
MAPK11 Q15759 1/20 0.40
MAPK14 Q16539 1/20 0.40
DYRK1A Q13627 2/20 0.40

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
SCHEMBL13633508 0.85 METTL3 (0.42) METTL3
SCHEMBL13633497 0.82 MAP3K5 (0.40) KDM4EALDH1A1NPC1RAB9APIK3CA
SCHEMBL16439325 0.80 KDM4E (0.42) KDM4EALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL2947671 0.79 MAP3K5 (0.64) KDM4EALDH1A1NPC1RAB9APIK3CA
SCHEMBL13633553 0.78 KMT2A (0.50) KDM4EALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL3260892 0.75 PIK3CA (0.43) PIK3CAMAP3K5PIK3CGPIK3CDPIK3CB
SCHEMBL20602411 0.73 KDM4E (0.53) KDM4EALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL3653537 0.72 PTGS1 (0.58) KDM4EALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL8337829 0.72 MAP3K5 (0.62) KDM4EALDH1A1NPC1RAB9APIK3CA
SCHEMBL8212717 0.72 PIK3CA (0.50) KDM4EPIK3CAMAP3K5PIK3CGPIK3CD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210371433-A1 Novel Monocyclic And Bicyclic Ring System Substituted Carbanucleoside Analogues For Use As PRMT5 Inhibitors JANSSEN PHARMACEUTICA NV (BE) 2021-12-02 US disclosed
US-20190263833-A1 NOVEL MONOCYCLIC AND BICYCLIC RING SYSTEM SUBSTITUTED CARBANUCLEOSIDE ANALOGUES FOR USE AS PRMT5 INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2019-08-29 US disclosed
US-20090275577-A1 IMIDAZOPYRIDINE AND IMIDAZOPYRIMIDINE DERIVATIVES AS ANTIBACTERIAL AGENTS PFIZER INC 2009-11-05 US disclosed
US-7563788-B2 Substituted Imidazo[1,2-a]pyridines as Antibacterial Agents PFIZER INC. (US) 2009-07-21 US disclosed
US-20070191394-A1 Antibacterial agents WARNER-LAMBERT COMPANY LLC 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 (4 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-20190263833-A1 NOVEL MONOCYCLIC AND BICYCLIC RING SYSTEM SUBSTITUTED CARBANUCLEOSIDE ANALOGUES FOR USE AS PRMT5 INHIBITORS PRMT5, PRMT1, PRMT8 KDM4E 47/4885ALDH1A1 4206/4885NPC1 2629/4885
US-20210371433-A1 Novel Monocyclic And Bicyclic Ring System Substituted Carbanucleoside Analogues For Use As PRMT5 Inhibitors PRMT5, PRMT1, PRMT8 KDM4E 50/4885ALDH1A1 4287/4885NPC1 2590/4885
US-20070191394-A1 Antibacterial agents MRPL21, RPN2, FBL KDM4E 4500/4885ALDH1A1 637/4885NPC1 575/4885
US-20090275577-A1 IMIDAZOPYRIDINE AND IMIDAZOPYRIMIDINE DERIVATIVES AS ANTIBACTERIAL AGENTS DPYD, TYMP, ITPA KDM4E 4078/4885ALDH1A1 272/4885NPC1 1996/4885

“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.