SCHEMBL25784307

SCHEMBL25784307

CCOC(=O)c1nn(C2CC2)cc1C=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 4/20 0.39
NPC1 O15118 5/20 0.39
RAB9A P51151 4/20 0.39
ALDH1A1 P00352 3/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
LMNA P02545 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ADORA3 P0DMS8 1/20 0.37
ADORA2A P29274 1/20 0.37
ADORA1 P30542 1/20 0.37
TP53 P04637 1/20 0.36
ALOX12 P18054 1/20 0.36
GRK6 P43250 1/20 0.36
OPRM1 P35372 2/20 0.35
OPRK1 P41145 2/20 0.35
OGFRL1 Q5TC84 2/20 0.35

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
SCHEMBL25302211 0.83 NPC1 (0.42) ELANENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL22851065 0.82 NPC1 (0.53) ELANENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL5951738 0.81 ELANE (0.38) ELANENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL16244492 0.81 ADORA3 (0.41) ELANENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL30871800 0.79 PDE4A (0.39) ELANENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL27163129 0.79 ADORA2A (0.50) ELANENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL2671418 0.75 ADORA3 (0.42) ELANENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL21816295 0.74 TSHR (0.42) ELANENPC1RAB9AALDH1A1LMNA
SCHEMBL27163381 0.74 ADORA3 (0.41) ELANENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL23456899 0.74 DGAT1 (0.39) ELANENPC1RAB9AALDH1A1SMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230357260-A1 HETEROCYCLIC COMPOUNDS, PREPARATION METHODS THEREFOR, AND METHODS OF USES THEREOF InventisBio Co., Ltd. (CN) 2023-11-09 US disclosed
US-20230357260-A1 HETEROCYCLIC COMPOUNDS, PREPARATION METHODS THEREFOR, AND METHODS OF USES THEREOF InventisBio Co., Ltd. (CN) 2023-11-09 US disclosed
US-11691981-B2 Heterocyclic compounds, preparation methods therefor, and methods of uses thereof InventisBio Co., Ltd. (CN) 2023-07-04 US disclosed
US-11691981-B2 Heterocyclic compounds, preparation methods therefor, and methods of uses thereof InventisBio Co., Ltd. (CN) 2023-07-04 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 (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-20230357260-A1 HETEROCYCLIC COMPOUNDS, PREPARATION METHODS THEREFOR, AND METHODS OF USES THEREOF TGFB1, TGFB2, TGFBR1 ELANE 3920/4885NPC1 1455/4885RAB9A 2299/4885
US-11691981-B2 Heterocyclic compounds, preparation methods therefor, and methods of uses thereof TGFB1, TGFB2, TGFBR1 ELANE 3920/4885NPC1 1455/4885RAB9A 2299/4885

“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.