SCHEMBL3328282

SCHEMBL3328282

CC(C)N1C(=O)C(=O)c2cnccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
CDC25B P30305 1/20 0.42
CYP3A4 P08684 5/20 0.41
TSHR P16473 4/20 0.41
CYP2D6 P10635 1/20 0.41
MAPT P10636 3/20 0.38
TP53 P04637 2/20 0.38
CASP1 P29466 2/20 0.38
BLM P54132 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MAPK1 P28482 1/20 0.38
CASP7 P55210 1/20 0.38
ALDH1A1 P00352 2/20 0.38
IDO1 P14902 1/20 0.38
KDM4E B2RXH2 1/20 0.37
CA12 O43570 3/20 0.36
CA1 P00915 3/20 0.36
CA2 P00918 3/20 0.36
CA9 Q16790 3/20 0.36

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
SCHEMBL2474607 0.77 TTR (0.55) MAOAMAOBCDC25BCYP3A4TSHR
SCHEMBL11865351 0.77 ALDH1A1 (0.50) MAOAMAOBCDC25BCYP3A4TSHR
SCHEMBL28151567 0.76 LRRK2 (0.38) MAOAMAOBCDC25BCYP3A4TSHR
SCHEMBL4199767 0.74 CES1 (0.57) MAOAMAOBMAPTMAPK1ALDH1A1
Hydrochloric Acid SCHEMBL29591677 0.73 CES1 (0.55) MAOAMAOBMAPTMAPK1ALDH1A1
SCHEMBL17667418 0.72 PARK7 (0.53) MAOAMAOBCDC25BMAPTCASP1
SCHEMBL29407915 0.72 PARK7 (0.53) MAOAMAOBCDC25BMAPTCASP1
SCHEMBL20254407 0.70 ACHE (0.54) MAOAMAOBMAPTTP53SMN1; SMN2
SCHEMBL22667213 0.69 CUL4A (0.51) ALDH1A1IDO1CA1CA2CASP3
SCHEMBL30404657 0.69 CUL4A (0.51) ALDH1A1IDO1CA1CA2CASP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8642765-B2 Azaindole-indole coupled derivatives, preparation methods and uses thereof Cheng, Jingcai (CN) 2014-02-04 US disclosed
US-20100137356-A1 AZAINDOLE-INDOLE COUPLED DERIVATIVES, PREPARATION METHODS AND USES THEREOF Cheng, Jingcai (CN) 2010-06-03 US disclosed
EP-2168964-A1 AZAINDOLE-INDOLE COUPLED DERIVATIVES, PREPARATION METHODS AND USES THEREOF Cheng, Jingcai (CN) 2010-03-31 EP 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 (1 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-20100137356-A1 AZAINDOLE-INDOLE COUPLED DERIVATIVES, PREPARATION METHODS AND USES THEREOF IDO1, IDO2, INMT MAOA 78/4885MAOB 88/4885CDC25B 50/4885

“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.