SCHEMBL6467015

SCHEMBL6467015

Cc1cc(CNC2CCC(N(C(=O)C(F)(F)F)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)CC2)nc2ccccc12

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 12/20 0.39
CCR2 P41597 1/20 0.37
ADRA2A P08913 1/20 0.37
MCHR1 Q99705 1/20 0.37
RXFP1 Q9HBX9 2/20 0.36
S1PR5 Q9H228 2/20 0.36
USP2 O75604 1/20 0.36
NR2E1 Q9Y466 1/20 0.34

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
Trifluoroacetic Acid SCHEMBL6467012 0.81 ADRA2A (0.48) TACR1ADRA2AMCHR1RXFP1USP2
SCHEMBL6460870 0.76 KDM4E (0.52) ADRA2AMCHR1RXFP1USP2
SCHEMBL6462481 0.73 KDM4E (0.50) ADRA2AMCHR1RXFP1
SCHEMBL6464250 0.73 LMNA (0.50) ADRA2AMCHR1RXFP1
SCHEMBL6462855 0.72 MCHR1 (0.41) MCHR1
SCHEMBL6457061 0.71 KDM4E (0.48) ADRA2AMCHR1
SCHEMBL6459355 0.71 MCHR1 (0.46) MCHR1
SCHEMBL6879281 0.70 MCHR1 (0.58) ADRA2AMCHR1RXFP1
SCHEMBL6879276 0.70 MCHR1 (0.58) ADRA2AMCHR1RXFP1
SCHEMBL5524846 0.70 MCHR1 (0.51) ADRA2AMCHR1

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-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
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 TACR1 115/4885CCR2 661/4885ADRA2A 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.