SCHEMBL4177799

SCHEMBL4177799

O=C1CCC(=O)N1Cc1cccc(-c2ccc3nc(-c4ccccn4)nc(NC4CC4)c3c2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.43
KMT2A Q03164 5/20 0.43
HTT P42858 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
KDM4E B2RXH2 1/20 0.43
HSP90AA1 P07900 1/20 0.43
SLC2A1 P11166 1/20 0.43
NCOA1 Q15788 1/20 0.43
NCOA3 Q9Y6Q9 1/20 0.43
MAPT P10636 2/20 0.43
NTSR1 P30989 1/20 0.43
EGLN1 Q9GZT9 2/20 0.43
HIF1A Q16665 1/20 0.42
ACP1 P24666 1/20 0.41
GBA1 P04062 2/20 0.41
POLB P06746 1/20 0.41
USP2 O75604 3/20 0.41
CYP1A2 P05177 3/20 0.41

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
SCHEMBL4182349 0.90 LMNA (0.53) LMNAKMT2AHTTNPSR1SMN1; SMN2
SCHEMBL4168721 0.84 NPR1 (0.48) EGLN1AVPR1B
SCHEMBL4180714 0.83 EGLN1 (0.44) LMNAKMT2AHTTNPSR1MAPT
SCHEMBL4186187 0.83 NPR1 (0.45) LMNAEGLN1USP2CYP1A2CYP3A4
SCHEMBL4184096 0.83 NSD2 (0.46) LMNAKMT2AHTTNPSR1MAPT
SCHEMBL4178085 0.82 APP (0.47) EGLN1AVPR1B
SCHEMBL4173222 0.82 NSD2 (0.49) LMNAEGLN1USP2CYP1A2CYP3A4
SCHEMBL4184947 0.81 PDE5A (0.47) LMNAEGLN1USP2CYP1A2CYP3A4
SCHEMBL4184720 0.81 NSD2 (0.49)
SCHEMBL4183733 0.81 MAP4K4 (0.60) LMNAKMT2AKDM4EUSP2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090069320-A1 Substituted 4-Amino-Quinazoline Compounds with Metabotropic Glutamate Receptor Regulating Activity and Uses Thereof GRUENENTHAL GMBH (DE) 2009-03-12 US claimed
US-20090069320-A1 Substituted 4-Amino-Quinazoline Compounds with Metabotropic Glutamate Receptor Regulating Activity and Uses Thereof GRUENENTHAL GMBH (DE) 2009-03-12 US 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-20090069320-A1 Substituted 4-Amino-Quinazoline Compounds with Metabotropic Glutamate Receptor Regulating Activity and Uses Thereof GRM1, GRIN1, GRM2 LMNA 4687/4885KMT2A 1642/4885HTT 785/4885

“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.