SCHEMBL5520748

SCHEMBL5520748

NC(=O)C1(Cc2ccc(OC(F)(F)F)cc2)CCCCC1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
SLC6A4 P31645 5/20 0.44
SLC6A3 Q01959 3/20 0.44
SLC6A2 P23975 1/20 0.44
EPHX1 P07099 3/20 0.43
AMPD2 Q01433 1/20 0.41
LMNA P02545 1/20 0.41
EPHX2 P34913 3/20 0.40
HTR2C P28335 1/20 0.40
MAPK8 P45983 1/20 0.40
NLRP3 Q96P20 1/20 0.39
KCNH2 Q12809 1/20 0.39
GRIN2B Q13224 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
SCHEMBL5534706 0.81 SLC6A3 (0.45) SLC6A4SLC6A3SLC6A2
SCHEMBL5523971 0.81 ALDH1A1 (0.46) CYP3A4CYP2C19LMNAEPHX2
SCHEMBL4600032 0.77 EPHX1 (0.41) CYP3A4EPHX1
SCHEMBL2864888 0.76 MAOA (0.46) SLC6A4SLC6A3SLC6A2LMNA
SCHEMBL28780338 0.76 SLC6A2 (0.42) CYP3A4CYP2C9CYP2C19SLC6A4SLC6A3
SCHEMBL6244722 0.74 MAOA (0.47) SLC6A4SLC6A3SLC6A2LMNA
SCHEMBL28009767 0.73 ALDH1A1 (0.49) CYP3A4CYP2C19LMNA
SCHEMBL1826744 0.72 AKT2 (0.53) SLC6A4SLC6A3SLC6A2LMNAKCNH2
SCHEMBL1760955 0.71 ALDH1A1 (0.46) LMNA
SCHEMBL5526973 0.71 SLC6A4 (0.50) CYP3A4CYP2C9CYP2C19SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070010671-A1 Novel quinazoline derivatives and methods of treatment related to the use thereof ARENA PHARMACEUTICALS, INC. 2007-01-11 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-20070010671-A1 Novel quinazoline derivatives and methods of treatment related to the use thereof MCHR1, GPR119, MCHR2 CYP3A4 334/4885CYP2C9 1280/4885CYP2C19 317/4885

“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.