SCHEMBL7003133

SCHEMBL7003133

COc1ccc2cc3c(=O)n(C)ccn3c2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.44
HTR2A P28223 2/20 0.43
HTR2C P28335 2/20 0.43
PTPN1 P18031 1/20 0.41
MTNR1A P48039 4/20 0.39
MTNR1B P49286 4/20 0.39
ALDH1A1 P00352 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
POLB P06746 1/20 0.39
MAPK1 P28482 1/20 0.39
PDE2A O00408 1/20 0.39
PDE3B Q13370 1/20 0.39
PDE3A Q14432 1/20 0.39
GSTP1 P09211 1/20 0.38
HTR7 P34969 1/20 0.38
CCNE2 O96020 1/20 0.38
CDK4 P11802 1/20 0.38
PRKACA P17612 1/20 0.38
PRKACG P22612 1/20 0.38

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
SCHEMBL7002931 0.88 KDM4E (0.46) HTR2AHTR2CPTPN1MTNR1AMTNR1B
SCHEMBL7005436 0.80 MAPT (0.38) HTR2AHTR2CALDH1A1MEN1KMT2A
SCHEMBL7006729 0.79 ALOX5 (0.48) CA2MTNR1AMEN1KMT2AHTR7
SCHEMBL7006296 0.78 TP53 (0.38) HTR2AHTR2CMEN1KMT2AHTR7
SCHEMBL7006877 0.78 HTR3E (0.37) HTR2AHTR2CALDH1A1MEN1KMT2A
SCHEMBL7006177 0.78 DAO (0.36) HTR2AHTR2CALDH1A1MEN1KMT2A
SCHEMBL7004919 0.76 MEN1 (0.42) CA2HTR2AHTR2CMTNR1AMTNR1B
SCHEMBL7004254 0.76 DAO (0.46) ALDH1A1MEN1KMT2AMAPK1
SCHEMBL7007358 0.75 CREBBP (0.39) ALDH1A1
SCHEMBL7002522 0.74 NQO2 (0.42) ALDH1A1PDE3BPDE3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1200439-B1 1,2-DIHYDRO-1-OXO-PARAZINO(1,2-A) INDOLE DERIVATIVES NOVUSPHARMA SPA (IT) 2003-06-25 EP disclosed