SCHEMBL3589577

SCHEMBL3589577

Cc1[nH]c2c(OCc3ccccn3)ccnc2c1C

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SYK P43405 14/20 0.46
AURKB Q96GD4 4/20 0.45
INCENP Q9NQS7 4/20 0.45
MAOA P21397 1/20 0.44
BRD4 O60885 1/20 0.42
ABCB1 P08183 1/20 0.41
HTR1A P08908 1/20 0.41
DRD2 P14416 1/20 0.41
KDM4E B2RXH2 1/20 0.40
MAPT P10636 1/20 0.40
GCK P35557 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 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
SCHEMBL3583639 0.78 MAPT (0.38) BRD4ABCB1HTR1AKDM4EMAPT
SCHEMBL3597264 0.76 HTR6 (0.44) MAOAHTR1AMAPTNPC1RAB9A
SCHEMBL3582069 0.76 HTR6 (0.46) MAOABRD4HTR1ADRD2KDM4E
SCHEMBL3592904 0.76 HTR6 (0.42) KDM4EMAPTNPC1RAB9A
SCHEMBL3588534 0.76 MEN1 (0.44) MAOAKDM4EMAPTNPC1RAB9A
SCHEMBL3591662 0.76 KMT2A (0.48) BRD4HTR1AKDM4EMAPTNPC1
SCHEMBL3579422 0.74 IDO1 (0.39) MAOAKDM4EMAPTNPC1RAB9A
SCHEMBL3576383 0.73 MPO (0.40)
SCHEMBL3584464 0.72 GAA (0.46) KDM4EMAPT
SCHEMBL12301166 0.70 SYK (0.62) SYKAURKBINCENPABCB1HTR1A

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-1784403-B1 PYRROLO[3,2-B]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORP (KR) 2013-07-17 EP disclosed
US-7642269-B2 Pyrrolo[3,2-B]pyridine derivatives and processes for the preparation thereof YUHAN CORPORATION (KR) 2010-01-05 US disclosed
US-20070213358-A1 PYRROLO[3,2-B]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2007-09-13 US disclosed
EP-1784403-A1 PYRROLO[3,2-B]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF Yuhan Corporation (KR) 2007-05-16 EP disclosed
WO-2006038773-A1 PYRROLO[3,2-B]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2006-04-13 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 (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-20070213358-A1 PYRROLO[3,2-B]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF PGA5, ATP6AP1, PPOX SYK 1738/4885AURKB 2004/4885INCENP 3625/4885

“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.