SCHEMBL6467407

SCHEMBL6467407

COc1cc(NC(=O)NC2CCC(Nc3cc(N(C)C)c4ccccc4n3)CC2)cc(OC)c1OC

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.45
MCHR1 Q99705 2/20 0.44
ADRA2A P08913 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
PTK2 Q05397 1/20 0.43
POLB P06746 2/20 0.42
LMNA P02545 1/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
RAD52 P43351 1/20 0.41
UBE2M P61081 1/20 0.41
DCUN1D1 Q96GG9 1/20 0.41
THRB P10828 1/20 0.40
KDR P35968 1/20 0.40

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
SCHEMBL6467397 1.00 MAPT (0.45) MAPTMCHR1ADRA2ASMN1; SMN2PTK2
SCHEMBL6880550 0.91 MAPT (0.54) MAPTMCHR1ADRA2ASMN1; SMN2POLB
SCHEMBL6880545 0.91 MAPT (0.54) MAPTMCHR1ADRA2ASMN1; SMN2POLB
SCHEMBL6463160 0.89 MCHR1 (0.43) MAPTMCHR1ADRA2ASMN1; SMN2PTK2
SCHEMBL6463137 0.89 MCHR1 (0.43) MAPTMCHR1ADRA2ASMN1; SMN2PTK2
SCHEMBL6874136 0.87 MCHR1 (0.56) MAPTMCHR1ADRA2ASMN1; SMN2
SCHEMBL6874142 0.87 MCHR1 (0.56) MAPTMCHR1ADRA2ASMN1; SMN2
SCHEMBL6880945 0.87 IGF1R (0.51) MAPTMCHR1ADRA2ASMN1; SMN2POLB
SCHEMBL6880940 0.87 IGF1R (0.51) MAPTMCHR1ADRA2ASMN1; SMN2POLB
SCHEMBL6874813 0.86 MAPT (0.47) MAPTMCHR1ADRA2ASMN1; SMN2POLB

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
WO-2004087669-A1 NOVEL QUINOLINE, TETRAHYDROQUINAZOLINE, AND PYRIMIDINE DERIVATIVES AND METHODS OF TREATMENT RELATED TO THE USE THEREOF TAISHO PHARMACEUTICAL CO. LTD. (JP) 2004-10-14 WO claimed
EP-1464335-A2 Quinoline, tetrahydroquinoline and pyrimidine derivatives as mch antagonist Taisho Pharmaceutical Co. Ltd. (JP) 2004-10-06 EP claimed
US-20050197350-A1 Novel quinoline, tetrahydroquinazoline, and pyrimidine derivatives and methods of treatment related to the use thereof TAISHO PHARMACEUTICAL CO., LTD. 2005-09-08 US disclosed
WO-2004087669-A1 NOVEL QUINOLINE, TETRAHYDROQUINAZOLINE, AND PYRIMIDINE DERIVATIVES AND METHODS OF TREATMENT RELATED TO THE USE THEREOF TAISHO PHARMACEUTICAL CO. LTD. (JP) 2004-10-14 WO disclosed
EP-1464335-A2 Quinoline, tetrahydroquinoline and pyrimidine derivatives as mch antagonist Taisho Pharmaceutical Co. Ltd. (JP) 2004-10-06 EP 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-20050197350-A1 Novel quinoline, tetrahydroquinazoline, and pyrimidine derivatives and methods of treatment related to the use thereof HCRTR2, MCHR1, MCHR2 MAPT 517/4885MCHR1 2/4885ADRA2A 117/4885

“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.