SCHEMBL4664299

SCHEMBL4664299

CC1(C)OB(c2ccc(OCC3CCN(C=O)CC3)cc2)OC1(C)C

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41
SIGMAR1 Q99720 1/20 0.39
DGAT1 O75907 1/20 0.38
LPL P06858 1/20 0.38
LIPG Q9Y5X9 1/20 0.38

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
SCHEMBL4664263 0.85 CXCR1 (0.46) CA1CA2CA9
SCHEMBL21509219 0.85 CA1 (0.48) CA1CA2CA9DGAT1LPL
SCHEMBL28468963 0.82 CYP4F2 (0.47) CA1CA2CA9SIGMAR1
SCHEMBL16468054 0.82 HIF1A (0.41) CA1CA2CA9SIGMAR1
SCHEMBL29203465 0.82 CYP4F2 (0.47) CA1CA2CA9
SCHEMBL22815569 0.82 PARP15 (0.46) CA1CA2CA9DGAT1LPL
SCHEMBL14480739 0.82 PARP15 (0.46) CA1CA2CA9DGAT1LPL
SCHEMBL31425418 0.81 CA1 (0.41) CA1CA2CA9DGAT1LPL
SCHEMBL14862803 0.81 CA1 (0.44) CA1CA2CA9LPLLIPG
SCHEMBL387330 0.81 PARP15 (0.47) CA1CA2CA9DGAT1LPL

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-20080242681-A1 N-4-(6-(Hetero)Aryl-Pyrimidin-4-Ylaminophenyl)-Benzenesulfonamides as Kinase Inhibitors ALTANA PHARMA AG (DE) 2008-10-02 US disclosed
US-20080242681-A1 N-4-(6-(Hetero)Aryl-Pyrimidin-4-Ylaminophenyl)-Benzenesulfonamides as Kinase Inhibitors ALTANA PHARMA AG (DE) 2008-10-02 US disclosed
US-20080242681-A1 N-4-(6-(Hetero)Aryl-Pyrimidin-4-Ylaminophenyl)-Benzenesulfonamides as Kinase Inhibitors ALTANA PHARMA AG (DE) 2008-10-02 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 (1 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-20080242681-A1 N-4-(6-(Hetero)Aryl-Pyrimidin-4-Ylaminophenyl)-Benzenesulfonamides as Kinase Inhibitors MAP3K19, MAP3K6, MAP3K20 CA1 4864/4885CA2 3948/4885CA9 4418/4885

“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.