SCHEMBL22364183

SCHEMBL22364183

CNC(=O)OCc1cncc(Br)c1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
CYP1A2 P05177 2/20 0.41
CYP3A4 P08684 2/20 0.41
CYP2C19 P33261 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.40
ENPP2 Q13822 1/20 0.40
ATXN2 Q99700 1/20 0.40
POLB P06746 2/20 0.40
TSHR P16473 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TOP2A P11388 3/20 0.39
TOP2B Q02880 3/20 0.39
HCAR2 Q8TDS4 1/20 0.39
PKM P14618 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
SCHEMBL2903650 0.82 ALDH1A1 (0.46) KDM4ECYP1A2CYP3A4CYP2C19L3MBTL1
SCHEMBL20954377 0.80 CYP1A2 (0.41) KDM4ECYP1A2CYP3A4CYP2C19L3MBTL1
SCHEMBL28687511 0.79 KDM4E (0.49) KDM4ECYP1A2CYP3A4CYP2C19L3MBTL1
SCHEMBL3705785 0.78 CYP1A2 (0.44) KDM4ECYP1A2CYP3A4CYP2C19L3MBTL1
SCHEMBL16619651 0.78 P2RX7 (0.37) KDM4EL3MBTL1SMN1; SMN2MAPTHTT
SCHEMBL17986606 0.78 KDM4E (0.49) KDM4ECYP1A2CYP3A4CYP2C19SMN1; SMN2
SCHEMBL26850220 0.78 POLB (0.44) KDM4ECYP1A2CYP3A4CYP2C19L3MBTL1
SCHEMBL3151323 0.76 HCAR2 (0.56) CYP1A2CYP3A4CYP2C19HCAR2
SCHEMBL10682408 0.76 TACR1 (0.38) KDM4ECYP1A2CYP3A4CYP2C19L3MBTL1
SCHEMBL3515284 0.76 KDM4E (0.45) KDM4ECYP1A2CYP3A4CYP2C19SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10759799-B2 Indazole containing macrocycles and therapeutic uses thereof SAMUMED, LLC (US) 2020-09-01 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 (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-10759799-B2 Indazole containing macrocycles and therapeutic uses thereof WNT1, WNT3, WNT3A KDM4E 3083/4885CYP1A2 1492/4885CYP3A4 1935/4885

“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.