SCHEMBL4090434

SCHEMBL4090434

CC(C)CCOc1ccc2cc(Br)ccc2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.51
MAPK1 P28482 3/20 0.46
KDM1A O60341 1/20 0.46
EPHX2 P34913 1/20 0.44
MMP2 P08253 1/20 0.44
MMP13 P45452 1/20 0.44
NPSR1 Q6W5P4 1/20 0.43
LMNA P02545 2/20 0.42
MEN1 O00255 1/20 0.42
MAPT P10636 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
NCEH1 Q6PIU2 1/20 0.41
PDK2 Q15119 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MAOB P27338 1/20 0.41

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
SCHEMBL7585689 0.88 GSTO1 (0.45) TDP1MAPK1KDM1AMMP2MMP13
SCHEMBL10602019 0.85 TDP1 (0.58) TDP1MAPK1EPHX2MMP2MMP13
SCHEMBL941201 0.83 TDP1 (0.66) TDP1MAPK1EPHX2MAPTHTT
SCHEMBL7619788 0.82 KDM4E (0.61) TDP1MAPK1LMNAMAPTSMN1; SMN2
SCHEMBL6266635 0.81 KDM4E (0.52) TDP1LMNAMAPTHTTKMT2A
SCHEMBL30334792 0.80 CA12 (0.50) TDP1MAPK1KDM1ALMNAMAPT
SCHEMBL4057003 0.80 CA12 (0.50) TDP1MAPK1KDM1ANPSR1LMNA
SCHEMBL1608519 0.80 CA12 (0.50) TDP1MAPK1KDM1ALMNAMAPT
SCHEMBL24741309 0.79 TDP1 (0.51) TDP1MAPK1EPHX2MMP2MMP13
SCHEMBL31498434 0.79 KDM4E (0.47) TDP1MAPK1KDM1ANPSR1LMNA

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
EP-2065383-A1 Indazole compounds and methods of use thereof as protein kinase inhibitors Signal Pharmaceuticals, Inc. (US) 2009-06-03 EP disclosed
US-20090099178-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF BHAGWAT SHRIPAD S 2009-04-16 US disclosed
EP-1692128-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF AS PROTEIN KINASE INHIBITORS Signal Pharmaceuticals LLC (US) 2006-08-23 EP disclosed
US-20060004043-A1 Indazole compounds and methods of use thereof BHAGWAT SHRIPAD S 2006-01-05 US disclosed
WO-2005051942-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF AS PROTEIN KINASE INHIBITORS SIGNAL PHARMACEUTICALS, LLC (US) 2005-06-09 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-20090099178-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF WNT3, WNT3A, WNK3 TDP1 1958/4885MAPK1 171/4885KDM1A 3862/4885
US-20060004043-A1 Indazole compounds and methods of use thereof WNT3, WNT3A, WNK3 TDP1 1780/4885MAPK1 166/4885KDM1A 3917/4885

“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.