SCHEMBL9746174

SCHEMBL9746174

Cc1ccccc1COc1nccnc1N

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MPO P05164 1/20 0.50
ADRA2A P08913 1/20 0.48
ADRA2B P18089 1/20 0.48
ADRA2C P18825 1/20 0.48
MAOB P27338 2/20 0.45
NOS3 P29474 3/20 0.44
NOS2 P35228 3/20 0.44
NOS1 P29475 1/20 0.44
SGMS2 Q8NHU3 2/20 0.40
CDK4 P11802 2/20 0.40
CCND1 P24385 2/20 0.40
PSEN1 P49768 1/20 0.40
PSEN2 P49810 1/20 0.40
APH1B Q8WW43 1/20 0.40
NCSTN Q92542 1/20 0.40
APH1A Q96BI3 1/20 0.40
PSENEN Q9NZ42 1/20 0.40
KMT2A Q03164 1/20 0.40
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL9125515 0.79 LTA4H (0.61) MPOADRA2AADRA2BADRA2CNOS3
SCHEMBL6244167 0.75 LTA4H (0.61) MPOMAOBALDH1A1MAPTCDK1
SCHEMBL23013032 0.74 LOXL2 (0.53) NOS3NOS2NOS1KDM4EALDH1A1
SCHEMBL9748513 0.72 MAP4K4 (0.50) NOS3NOS2NOS1KMT2AKDM4E
SCHEMBL29683550 0.71 MPO (0.48) MPOADRA2AADRA2BADRA2CMAOB
SCHEMBL9390374 0.70 NOS3 (0.59) MAOBNOS3NOS2NOS1ALDH1A1
SCHEMBL21340421 0.70 MAOB (0.61) MAOBCDK4CCND1KMT2AKDM4E
SCHEMBL29975448 0.70 ADRA2A (0.51) MPOADRA2AADRA2BADRA2CMAOB
SCHEMBL17164556 0.70 MPO (0.47) MPOADRA2AADRA2BADRA2CMAOB
SCHEMBL5797839 0.70 ALDH1A1 (0.57) ADRA2AADRA2BADRA2CMAOBKMT2A

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
EP-0204285-B1 IMIDAZOHETEROCYCLIC COMPOUNDS PROCESSES FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-01-15 EP disclosed
US-4725601-A Certain imidazo[1,2-a]pyridines useful in the treatment of ulcers FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-02-16 US disclosed
EP-0204285-A1 Imidazoheterocyclic compounds processes for preparation thereof and pharmaceutical compositions comprising them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-12-10 EP disclosed