SCHEMBL5539079

SCHEMBL5539079

Cc1onc(-c2ccccc2)c1NC(=O)N(C)C1CCCCC1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.56
NPSR1 Q6W5P4 1/20 0.54
RAB9A P51151 3/20 0.51
ABCC1 P33527 2/20 0.51
NPC1 O15118 1/20 0.51
ALDH1A1 P00352 2/20 0.51
LMNA P02545 2/20 0.51
HTT P42858 2/20 0.51
KDM4E B2RXH2 1/20 0.47
NTRK1 P04629 1/20 0.47
POLB P06746 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
MAPT P10636 1/20 0.45
TSHR P16473 1/20 0.45
KMT2A Q03164 2/20 0.43

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
SCHEMBL5537590 0.82 ATM (0.56) ATMRAB9AABCC1NPC1ALDH1A1
SCHEMBL4030960 0.78 FAAH (0.52) NPSR1ALDH1A1LMNAHTTKDM4E
SCHEMBL4029460 0.77 NPSR1 (0.61) NPSR1ALDH1A1HTTKDM4ENTRK1
SCHEMBL4030961 0.74 LMNA (0.47) NPSR1RAB9ANPC1ALDH1A1LMNA
SCHEMBL5527223 0.73 MEN1 (0.61) NPSR1ALDH1A1HTTKDM4ENTRK1
SCHEMBL26605784 0.73 ATM (0.64) ATMNPSR1RAB9AABCC1NPC1
SCHEMBL11599130 0.73 ATM (1.00) ATMRAB9AABCC1NPC1ALDH1A1
SCHEMBL17790727 0.72 MAPT (0.60) NPSR1ALDH1A1HTTKDM4ENTRK1
SCHEMBL22256920 0.70 ATM (0.44) ATMRAB9AABCC1NPC1KDM4E
SCHEMBL22257222 0.70 TRPV1 (0.45) ATMRAB9AABCC1NPC1KDM4E

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 ATM 2072/4885NPSR1 62/4885RAB9A 902/4885

“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.