SCHEMBL1366703

SCHEMBL1366703

Cc1nc(-c2ccccc2)ncc1C(=O)NC1CCN(CC2CCOCC2)CC1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.55
HTR4 Q13639 4/20 0.49
GABRA5 P31644 3/20 0.46
RIPK2 O43353 1/20 0.45
FLT3 P36888 3/20 0.44
TYRO3 Q06418 3/20 0.44
MERTK Q12866 3/20 0.44
AXL P30530 2/20 0.44
CRHR1 P34998 1/20 0.43
CRHR2 Q13324 1/20 0.43
POLB P06746 1/20 0.43
CYP3A4 P08684 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
GAS6 Q14393 2/20 0.42
HPGDS O60760 1/20 0.42
TTK P33981 2/20 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
SCHEMBL1366388 0.84 POLB (0.63) POLBCYP3A4SMN1; SMN2
SCHEMBL1364923 0.82 DGAT1 (0.53) DGAT1GABRA5FLT3TYRO3MERTK
SCHEMBL14094525 0.82 DGAT1 (0.53) DGAT1CRHR1CRHR2POLBSMN1; SMN2
SCHEMBL1366822 0.80 DRD4 (0.60) DGAT1POLBSMN1; SMN2
SCHEMBL1367559 0.79 DGAT1 (0.51) DGAT1HTR4GABRA5FLT3TYRO3
SCHEMBL2074161 0.79 HPGDS (0.67) HTR4GABRA5RIPK2HPGDSTTK
SCHEMBL4406616 0.79 KDM4E (0.58) SMN1; SMN2
SCHEMBL1364239 0.78 DGAT1 (0.48) DGAT1SMN1; SMN2
SCHEMBL1367494 0.73 SLC6A12 (0.62) POLBCYP3A4
SCHEMBL1366693 0.72 PARP1 (0.49) HTR4POLBSMN1; SMN2HPGDS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8067589-B2 Heterocyclic compounds useful in treating diseases and conditions PFIZER INC (US) 2011-11-29 US disclosed
US-20090281125-A1 Heterocyclic Compounds Useful in Treating Diseases and Conditions BLAKE TANISHA D 2009-11-12 US disclosed
US-7582643-B2 Heterocyclic compounds useful in treating diseases and conditions PFIZER INC (US) 2009-09-01 US disclosed
US-20080207651-A1 Heterocyclic compounds useful in treating diseases and conditions BLAKE TANISHA D 2008-08-28 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 (2 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-20090281125-A1 Heterocyclic Compounds Useful in Treating Diseases and Conditions CYP11B2, CYP11B1, LTC4S DGAT1 1566/4885HTR4 947/4885GABRA5 1644/4885
US-20080207651-A1 Heterocyclic compounds useful in treating diseases and conditions CYP11B2, CYP11B1, LTC4S DGAT1 1566/4885HTR4 947/4885GABRA5 1644/4885

“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.