SCHEMBL21032260

SCHEMBL21032260

C=CCCC(C)N1CCCCC1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35
FAAH O00519 1/20 0.33
SLC6A2 P23975 1/20 0.31
SLC6A3 Q01959 1/20 0.31

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
SCHEMBL21540021 0.79 CYP3A4 (0.38) CYP3A4CYP2D6CYP2C19
SCHEMBL23869469 0.79 CYP3A4 (0.38) CYP3A4CYP2D6CYP2C19
SCHEMBL27547702 0.79 OPRM1 (0.32) CYP3A4CYP2D6CYP2C19
SCHEMBL7446973 0.76 CYP3A4 (0.38) CYP3A4CYP2D6CYP2C19
SCHEMBL20072726 0.74 CYP3A4 (0.34) CYP3A4CYP2D6CYP2C19
SCHEMBL12599477 0.73 ALOX15 (0.44)
SCHEMBL10644166 0.73 HRH3 (0.35)
SCHEMBL3308637 0.73 SLC6A3 (0.37) CYP3A4CYP2D6CYP2C19SLC6A2SLC6A3
SCHEMBL19272636 0.73 SLC6A3 (0.37) CYP3A4CYP2D6CYP2C19SLC6A2SLC6A3
SCHEMBL17706430 0.73 OPRL1 (0.41) CYP3A4CYP2D6CYP2C19

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-20190275012-A9 SUBSTITUTED THIAZOLO-PYRIDINE COMPOUNDS AS MALT1 INHIBITORS LUPIN LIMITED (IN) 2019-09-12 US disclosed
US-20190160045-A1 SUBSTITUTED THIAZOLO-PYRIDINE COMPOUNDS AS MALT1 INHIBITORS LUPIN LTD (IN) 2019-05-30 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-20190275012-A9 SUBSTITUTED THIAZOLO-PYRIDINE COMPOUNDS AS MALT1 INHIBITORS MALT1, PTP4A1, PTPRO CYP3A4 784/4885CYP2D6 1127/4885CYP2C19 1878/4885
US-20190160045-A1 SUBSTITUTED THIAZOLO-PYRIDINE COMPOUNDS AS MALT1 INHIBITORS MALT1, PTP4A1, PTPRO CYP3A4 784/4885CYP2D6 1127/4885CYP2C19 1878/4885

“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.