SCHEMBL27101554

SCHEMBL27101554

CN(CCO)c1ncc(Br)cn1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.46
HSD17B10 Q99714 3/20 0.36
OPRM1 P35372 2/20 0.36
OPRL1 P41146 2/20 0.36
EGFR P00533 4/20 0.35
MAPK1 P28482 1/20 0.34
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
GBA1 P04062 1/20 0.32
MAPT P10636 1/20 0.32
SLC29A1 Q99808 1/20 0.32
ALOX15 P16050 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
SCHEMBL22538597 0.82 POLB (0.47) POLBHSD17B10OPRM1OPRL1MAPK1
SCHEMBL6158014 0.79 POLB (0.52) POLBHSD17B10OPRM1OPRL1EGFR
SCHEMBL3606370 0.77 ACACB (0.41) HSD17B10MAPK1ALDH1A1
SCHEMBL7258115 0.77 PTPN11 (0.36) MAPK1GBA1
SCHEMBL19105546 0.77 POLB (0.43) POLBHSD17B10OPRM1OPRL1MAPK1
SCHEMBL23171270 0.77 POLB (0.43) POLBHSD17B10OPRM1OPRL1MAPK1
SCHEMBL17654205 0.77 GBA1 (0.44) MAPK1KDM4EALDH1A1GBA1
SCHEMBL5255404 0.76 GBA1 (0.53) POLBEGFRALDH1A1GBA1MAPT
SCHEMBL5763107 0.76 BRD4 (0.33) ALDH1A1
SCHEMBL21768459 0.76 OPRM1 (0.43) POLBOPRM1OPRL1EGFRMAPT

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-11912701-B2 Protein kinase inhibitors for promoting liver regeneration or reducing or preventing hepatocyte death HEPAREGENIX GMBH (DE) 2024-02-27 US disclosed
US-11912701-B2 Protein kinase inhibitors for promoting liver regeneration or reducing or preventing hepatocyte death HEPAREGENIX GMBH (DE) 2024-02-27 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-11912701-B2 Protein kinase inhibitors for promoting liver regeneration or reducing or preventing hepatocyte death MAPK4, MAPK7, MAPK14 POLB 3499/4885HSD17B10 1076/4885OPRM1 2646/4885

“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.