SCHEMBL23625902

SCHEMBL23625902

CCOC(=O)c1nc2cc3c(cc2cc1-[n+]1ccccc1)OCO3

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.48
TDP1 Q9NUW8 2/20 0.48
SMN1; SMN2 Q16637 5/20 0.45
HSD17B10 Q99714 5/20 0.45
KDM4E B2RXH2 4/20 0.45
TP53 P04637 2/20 0.45
MAPT P10636 5/20 0.44
NPC1 O15118 4/20 0.44
RXFP1 Q9HBX9 3/20 0.44
TSHR P16473 1/20 0.44
ALDH1A1 P00352 8/20 0.43
HPGD P15428 6/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
RAB9A P51151 4/20 0.42
ALOX15 P16050 2/20 0.42
CYP19A1 P11511 1/20 0.42
ELANE P08246 1/20 0.41
ATM Q13315 2/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 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
SCHEMBL24823396 0.85 NPC1 (0.42) LMNATDP1SMN1; SMN2HSD17B10KDM4E
Bromide SCHEMBL29010815 0.84 NPC1 (0.42) LMNATDP1SMN1; SMN2HSD17B10KDM4E
Bromide SCHEMBL29010830 0.84 NPC1 (0.42) LMNATDP1SMN1; SMN2HSD17B10KDM4E
Bromide SCHEMBL30310971 0.84 NPC1 (0.42) LMNATDP1SMN1; SMN2HSD17B10KDM4E
Bromide SCHEMBL31391625 0.84 TARBP2 (0.36) LMNATDP1HSD17B10KDM4EMAPT
SCHEMBL24823310 0.81 MAPT (0.42) LMNASMN1; SMN2KDM4ETP53MAPT
Bromide SCHEMBL30310918 0.81 TARBP2 (0.37) LMNATDP1SMN1; SMN2HSD17B10KDM4E
Bromide SCHEMBL29010847 0.81 TARBP2 (0.37) LMNATDP1SMN1; SMN2HSD17B10KDM4E
SCHEMBL24824325 0.81 HTR1D (0.36) LMNATDP1KDM4EALDH1A1HPGD
Bromide SCHEMBL30311003 0.81 MAPT (0.42) LMNASMN1; SMN2KDM4ETP53MAPT

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-20230021669-A1 TRICYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF The National Institutes of Pharmaceutical R&D Co., Ltd. (CN) 2023-01-26 US disclosed
WO-2021136244-A1 TRICYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF 中国医药研究开发中心有限公司 2021-07-08 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 (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-20230021669-A1 TRICYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF CYP4A11, CYP4F11, CYP11B2 LMNA 1304/4885TDP1 1427/4885SMN1; SMN2 3789/4885

“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.