SCHEMBL2733434

SCHEMBL2733434

CC(C)(C)OC(=O)N1CCN(Cc2cscn2)CC1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.44
CHRM4 P08173 1/20 0.44
CHRM1 P11229 1/20 0.44
CHRM3 P20309 1/20 0.44
ACKR3 P25106 3/20 0.43
VEGFA P15692 1/20 0.42
EGLN1 Q9GZT9 1/20 0.42
POLB P06746 1/20 0.42
SRPK1 Q96SB4 2/20 0.41
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
DTYMK P23919 1/20 0.41
GPR119 Q8TDV5 3/20 0.41
OPRM1 P35372 1/20 0.40
OPRD1 P41143 1/20 0.40
KCNH2 Q12809 1/20 0.40
TERT O14746 1/20 0.40
CCNK O75909 1/20 0.39
CDK12 Q9NYV4 1/20 0.39

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
SCHEMBL28289061 0.80 OPRD1 (0.40) SRPK1OPRM1OPRD1KCNH2
SCHEMBL210366 0.79 OPRD1 (0.42) SRPK1ALDH1A1KDM4EOPRM1OPRD1
SCHEMBL21579067 0.79 ACKR3 (0.49) CHRM2CHRM4CHRM1CHRM3ACKR3
SCHEMBL2734028 0.79 ALDH1A1 (0.60) CHRM2CHRM4CHRM1CHRM3ACKR3
SCHEMBL465777 0.78 SMN1; SMN2 (0.51) CHRM2CHRM4CHRM1CHRM3ACKR3
SCHEMBL13532856 0.77 POLB (0.50) POLBALDH1A1GPR119
SCHEMBL1956090 0.77 KCNA3 (0.47)
SCHEMBL28705806 0.77 GPR119 (0.54) CHRM2CHRM4CHRM1CHRM3POLB
SCHEMBL30521135 0.77 GPR119 (0.54) CHRM2CHRM4CHRM1CHRM3POLB
SCHEMBL2731874 0.77 CHRM2 (0.44) CHRM2CHRM4CHRM1CHRM3ACKR3

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 CHRM2 941/4885CHRM4 1370/4885CHRM1 480/4885
US-11660303-B2 2-phenylimidazo[4,5-b]pyridin-7-amine derivates useful as inhibitors of mammalian tyrosine kinase ROR1 activity ROR1, RORB, RORA CHRM2 4305/4885CHRM4 4269/4885CHRM1 3417/4885

“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.