SCHEMBL22858554

SCHEMBL22858554

COc1cc(N2CCN(CCO)CC2)c(Cl)cc1N

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.47
DRD3 P35462 1/20 0.47
HTR4 Q13639 7/20 0.47
ADORA2B P29275 4/20 0.47
POLB P06746 1/20 0.46
DRD4 P21917 1/20 0.45
OPRM1 P35372 5/20 0.44
OPRK1 P41145 5/20 0.44
OPRL1 P41146 5/20 0.44
PDCD1 Q15116 1/20 0.44
RBM17 Q96I25 1/20 0.44
CD274 Q9NZQ7 1/20 0.44
GAA P10253 1/20 0.44
SUV39H2 Q9H5I1 2/20 0.41

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
SCHEMBL29508977 1.00 DRD2 (0.47) DRD2DRD3HTR4ADORA2BPOLB
SCHEMBL19175211 0.87 HTR4 (0.49) HTR4ADORA2BDRD4GAASUV39H2
SCHEMBL19175191 0.85 CHRM1 (0.48) HTR4ADORA2BOPRL1GAA
SCHEMBL6497356 0.84 DRD2 (0.55) DRD2DRD3OPRM1OPRK1OPRL1
SCHEMBL311333 0.84 HTR4 (0.44) HTR4ADORA2BDRD4GAA
SCHEMBL29508898 0.83 MAPT (0.54) DRD2DRD3POLBDRD4GAA
SCHEMBL22858439 0.83 MAPT (0.54) DRD2DRD3POLBDRD4GAA
SCHEMBL22858617 0.79 ALDH1A1 (0.46) DRD2DRD3POLBOPRM1OPRK1
SCHEMBL29508999 0.79 ALDH1A1 (0.46) DRD2DRD3POLBOPRM1OPRK1
SCHEMBL22858591 0.77 HTR3A (0.57) DRD2DRD3DRD4GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11529350-B2 Tyrosine kinase non-receptor 1 (TNK1) inhibitors and uses thereof SUMITOMO PHARMA ONCOLOGY, INC. (US) 2022-12-20 US disclosed
WO-2021003417-A1 TYROSINE KINASE NON-RECEPTOR 1 (TNK1) INHIBITORS AND USES THEREOF SUMITOMO DAINIPPON PHARMA ONCOLOGY, INC. (US) 2021-01-07 WO disclosed
US-20210000825-A1 Tyrosine Kinase Non-Receptor 1 (TNK1) Inhibitors and Uses Thereof SUMITOMO PHARMA ONCOLOGY, INC. 2021-01-07 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-20210000825-A1 Tyrosine Kinase Non-Receptor 1 (TNK1) Inhibitors and Uses Thereof TNK1, TNNI3K, TYK2 DRD2 4228/4885DRD3 3893/4885HTR4 1684/4885
US-11529350-B2 Tyrosine kinase non-receptor 1 (TNK1) inhibitors and uses thereof TNK1, TNNI3K, TYK2 DRD2 4228/4885DRD3 3893/4885HTR4 1684/4885

“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.