SCHEMBL2733360

SCHEMBL2733360

CC(C)(C)OC(=O)N1CCN(Cc2nccs2)CC1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 9/20 0.60
TSHR P16473 5/20 0.54
CYP2D6 P10635 5/20 0.52
CYP2C19 P33261 2/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
MAPK1 P28482 2/20 0.48
CYP2C9 P11712 2/20 0.47
USP2 O75604 3/20 0.47
DTYMK P23919 1/20 0.46
ALDH1A1 P00352 2/20 0.46
MGLL Q99685 1/20 0.45
HRH2 P25021 1/20 0.45
HRH1 P35367 1/20 0.45
GPR119 Q8TDV5 1/20 0.45
TP53 P04637 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
POLB P06746 1/20 0.44

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
SCHEMBL22584709 0.81 CYP3A4 (0.46) CYP3A4TSHRCYP2D6CYP2C19SMN1; SMN2
SCHEMBL28709541 0.81 CYP3A4 (0.46) CYP3A4TSHRCYP2D6CYP2C19SMN1; SMN2
SCHEMBL28705734 0.81 GPR119 (0.43) CYP3A4TSHRCYP2D6CYP2C19MAPK1
SCHEMBL4840835 0.81 CHRM2 (0.48) CYP3A4DTYMKGPR119POLB
SCHEMBL4773996 0.80 GPR119 (0.51) CYP3A4GPR119
SCHEMBL28872036 0.80 TSHR (0.51) CYP3A4TSHRCYP2D6CYP2C19SMN1; SMN2
SCHEMBL209379 0.79 TSHR (0.59) CYP3A4TSHRCYP2D6CYP2C19SMN1; SMN2
SCHEMBL1087873 0.79 CYP3A4 (0.43) CYP3A4TSHRCYP2D6CYP2C19SMN1; SMN2
SCHEMBL1087874 0.79 CYP3A4 (0.43) CYP3A4TSHRCYP2D6CYP2C19SMN1; SMN2
SCHEMBL209862 0.79 CHRM2 (0.44) CYP3A4SMN1; SMN2DTYMKGPR119POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11660303-B2 2-phenylimidazo[4,5-b]pyridin-7-amine derivates useful as inhibitors of mammalian tyrosine kinase ROR1 activity KANCERA AB (SE) 2023-05-30 US disclosed
CN-109563092-B 2-phenylimidazo [4,5-B ] pyridin-7-amine derivatives useful as inhibitors of the activity of the mammalian tyrosine kinase ROR1 坎塞拉有限公司 2021-09-14 CN disclosed
US-8088761-B2 Enzyme inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2012-01-03 US disclosed
US-8088761-B2 Enzyme inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2012-01-03 US disclosed
US-20090247507-A1 Enzyme Inhibitors THE INSTITUTE OF CANCER RESEARCH (GB) 2009-10-01 US disclosed
US-20090247507-A1 Enzyme Inhibitors THE INSTITUTE OF CANCER RESEARCH (GB) 2009-10-01 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-20090247507-A1 Enzyme Inhibitors AURKC, AURKB, AURKA CYP3A4 439/4885TSHR 2859/4885CYP2D6 1028/4885
US-11660303-B2 2-phenylimidazo[4,5-b]pyridin-7-amine derivates useful as inhibitors of mammalian tyrosine kinase ROR1 activity ROR1, RORB, RORA CYP3A4 1966/4885TSHR 1024/4885CYP2D6 1936/4885

“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.