SCHEMBL23411995

SCHEMBL23411995

COC(=O)c1cc(OC)c(Br)c(O)c1[N+](=O)[O-]

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.47
KDM4E B2RXH2 4/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
MAPT P10636 1/20 0.41
POLB P06746 4/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
CTDSP1 Q9GZU7 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
COMT P21964 1/20 0.39
ABCB1 P08183 1/20 0.39
ABCC1 P33527 1/20 0.39
HTT P42858 1/20 0.39
HSD17B10 Q99714 2/20 0.38
USP2 O75604 1/20 0.38
ERN1 O75460 1/20 0.38
LMNA P02545 1/20 0.37
LCK P06239 1/20 0.37
FYN P06241 1/20 0.37

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
SCHEMBL9272063 0.87 TSHR (0.40) PKMSMN1; SMN2MAPTPOLBL3MBTL1
SCHEMBL23412396 0.86 PKM (0.57) PKMKDM4ESMN1; SMN2MAPTPOLB
SCHEMBL5962841 0.81 PKM (0.58) PKMKDM4ESMN1; SMN2MAPTPOLB
SCHEMBL28740427 0.79 SMN1; SMN2 (0.41) PKMKDM4ESMN1; SMN2MAPTPOLB
SCHEMBL28414234 0.78 PKM (0.48) PKMKDM4ESMN1; SMN2MAPTPOLB
SCHEMBL2907457 0.78 PKM (0.75) PKMKDM4ESMN1; SMN2MAPTPOLB
SCHEMBL728962 0.78 KDM4E (0.50) PKMKDM4ESMN1; SMN2MAPTPOLB
SCHEMBL12082273 0.76 SMN1; SMN2 (0.48) PKMKDM4ESMN1; SMN2MAPTPOLB
SCHEMBL1553222 0.76 TDP1 (0.51) PKMKDM4ESMN1; SMN2MAPTPOLB
SCHEMBL5962801 0.75 PKM (0.58) PKMKDM4ESMN1; SMN2MAPTPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12435066-B2 Substituted tricyclic compounds LUPIN LIMITED (IN) 2025-10-07 US disclosed
CN-114746411-B Substituted tricyclic compounds 印度鲁宾有限公司 2024-06-25 CN disclosed
EP-4065575-B1 SUBSTITUTED TRICYCLIC COMPOUNDS LUPIN LTD (IN) 2024-01-31 EP disclosed
US-20230013778-A1 SUBSTITUTED TRICYCLIC COMPOUNDS LUPIN LIMITED (IN) 2023-01-19 US disclosed
EP-4065575-A1 SUBSTITUTED TRICYCLIC COMPOUNDS Lupin Limited (IN) 2022-10-05 EP disclosed
CN-114746411-A Substituted tricyclic compounds 印度鲁宾有限公司 2022-07-12 CN disclosed
WO-2021105960-A1 SUBSTITUTED TRICYCLIC COMPOUNDS LUPIN LIMITED (IN) 2021-06-03 WO 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-20230013778-A1 SUBSTITUTED TRICYCLIC COMPOUNDS SOS1, RSU1, KSR1 PKM 2600/4885KDM4E 4652/4885SMN1; SMN2 575/4885
US-12435066-B2 Substituted tricyclic compounds SOS1, RSU1, KSR1 PKM 2600/4885KDM4E 4652/4885SMN1; SMN2 575/4885

“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.