SCHEMBL3842522

SCHEMBL3842522

Cc1c(C(N)=O)c(NCCN2CCOCC2)nc2cc[c]cc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 5/20 0.46
CYP3A4 P08684 5/20 0.46
CYP2D6 P10635 5/20 0.46
HSD17B10 Q99714 4/20 0.46
TDP1 Q9NUW8 2/20 0.46
TOP2A P11388 1/20 0.46
CSNK2A1 P68400 1/20 0.44
USP2 O75604 3/20 0.44
ALOX15 P16050 3/20 0.44
ACP1 P24666 1/20 0.43
LMNA P02545 5/20 0.43
KDM4E B2RXH2 3/20 0.43
HTT P42858 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
GAA P10253 1/20 0.42
MEN1 O00255 2/20 0.42
POLB P06746 2/20 0.42
KMT2A Q03164 2/20 0.42
MAPT P10636 1/20 0.42
PTK2B Q14289 1/20 0.42

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
SCHEMBL5910177 0.74 KDM4E (0.37) LMNAKDM4E
SCHEMBL2929617 0.72 ALDH1A1 (0.42) CYP1A2CYP3A4CYP2D6HSD17B10TOP2A
SCHEMBL5910137 0.72
SCHEMBL5909895 0.71 HRH3 (0.37)
SCHEMBL10996176 0.70 CYP3A4 (0.48) CYP1A2CYP3A4CYP2D6HSD17B10TDP1
SCHEMBL5911064 0.69 PARP1 (0.42) CYP1A2CYP3A4CYP2D6HSD17B10ALOX15
SCHEMBL5910081 0.67 HRH3 (0.41) HSD17B10ACP1KDM4ESMN1; SMN2GAA
SCHEMBL3033791 0.67 POLB (0.58) LMNAMEN1POLBKMT2AALDH1A1
SCHEMBL28282944 0.67 KDM4E (0.59) HSD17B10KDM4ESMN1; SMN2MAPTALDH1A1
SCHEMBL5910031 0.67 IKBKB (0.36) CYP2C19KCNH2TSHR

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
EP-1828207-B1 THIAZOLOPYRIDINONE DERIVATES AS MCH RECEPTOR ANTAGONISTS LILLY CO ELI (US) 2009-10-28 EP disclosed
US-20090233919-A1 THIAZOLOPYRIDINONE DERIVATES AS MCH RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY 2009-09-17 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-20090233919-A1 THIAZOLOPYRIDINONE DERIVATES AS MCH RECEPTOR ANTAGONISTS MCHR1, MCHR2, MC1R CYP1A2 1074/4885CYP3A4 2404/4885CYP2D6 1207/4885

“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.