SCHEMBL4089436

SCHEMBL4089436

CCOc1ccc2cc(C=O)ccc2c1.N#Cc1ccc(F)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.47
GLA P06280 1/20 0.43
MAOA P21397 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 3/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
FAAH O00519 1/20 0.40
RELA Q04206 1/20 0.39
MAPT P10636 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ESR1 P03372 2/20 0.39
AHR P35869 1/20 0.39
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.38
TRPV4 Q9HBA0 1/20 0.38
POLB P06746 1/20 0.38
HPGD P15428 1/20 0.38
P4HB P07237 1/20 0.38
PTGS2 P35354 1/20 0.37

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
SCHEMBL4089424 0.82 ALDH1A1 (0.53) MEN1KMT2AALDH1A1RELAMAPT
SCHEMBL7565814 0.76 SLC6A2 (0.56) GLAMEN1KMT2AALDH1A1L3MBTL1
SCHEMBL10485807 0.76 RELA (0.65) KMT2AALDH1A1RELAMAPTSMN1; SMN2
SCHEMBL11036527 0.74 CYP11B1 (0.52) GLAALDH1A1MAPTLMNATP53
SCHEMBL1250094 0.73 CA1 (0.46) ALDH1A1PTGS2
SCHEMBL509602 0.72 NQO1 (0.67) MAOBGLAALDH1A1RELAMAPT
SCHEMBL6557043 0.71 MAOA (0.51) MAOBMAOAMEN1KMT2AALDH1A1
SCHEMBL10363683 0.71 NQO1 (0.52) MAOBMEN1KMT2AL3MBTL1MAPT
Alcohol SCHEMBL29171755 0.71 NQO1 (0.58) MAOBALDH1A1MAPTLMNATP53
SCHEMBL342467 0.71 NQO1 (0.64) MEN1KMT2AALDH1A1RELAMAPT

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 MAOB 3587/4885GLA 3459/4885MAOA 3407/4885
US-20060004043-A1 Indazole compounds and methods of use thereof WNT3, WNT3A, WNK3 MAOB 3738/4885GLA 3508/4885MAOA 3616/4885

“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.