SCHEMBL4283708

SCHEMBL4283708

[O]C1C=Cc2ccccc2N1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
CREBBP Q92793 2/20 0.31
BRPF1 P55201 1/20 0.31
P2RX4 Q99571 1/20 0.31
TNKS2 Q9H2K2 2/20 0.30
BRD4 O60885 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPK1 P28482 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL18562457 0.74 GAA (0.44) GAAMAPT
SCHEMBL4540870 0.74 GAA (0.44) GAAMAPT
SCHEMBL7442660 0.74 GAA (0.44) GAAMAPTMEN1KMT2A
SCHEMBL6056252 0.74 GAA (0.44) GAAMAPTCREBBPBRPF1P2RX4
SCHEMBL6111309 0.74 GAA (0.44) GAAMAPTCREBBPP2RX4BRD4
SCHEMBL5470066 0.74 GAA (0.44) GAAMAPT
SCHEMBL12159337 0.74 GAA (0.44) GAAMAPTCREBBPBRPF1P2RX4
SCHEMBL16320608 0.74 GAA (0.40) GAAMAPT
SCHEMBL2464235 0.74 GAA (0.40) GAAMAPTP2RX4
Hydrochloric Acid SCHEMBL7448871 0.72 GAA (0.43) GAAMAPT

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-20090227560-A1 Substituted imidazole compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-09-10 US disclosed
US-20090156612-A1 Substituted imidazole compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-18 US disclosed
WO-2008139941-A1 SUBSTITUTED IMIDAZOLE COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-11-20 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-20090156612-A1 Substituted imidazole compound and use thereof REN, ACE, AGT GAA 1381/4885MAPT 3142/4885CREBBP 1136/4885
US-20090227560-A1 Substituted imidazole compound and use thereof REN, ACE, AGT GAA 1381/4885MAPT 3142/4885CREBBP 1136/4885

“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.