SCHEMBL22648680

SCHEMBL22648680

CCOC(=O)C(C)n1cc(N)cn1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.39
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
KMT2A Q03164 3/20 0.37
HPGD P15428 2/20 0.37
RAB9A P51151 3/20 0.37
KDM4E B2RXH2 3/20 0.37
NPC1 O15118 2/20 0.37
LMNA P02545 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
MAOA P21397 1/20 0.37
ACHE P22303 3/20 0.36
ALDH1A1 P00352 6/20 0.36
MAPT P10636 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
GAA P10253 2/20 0.36
MEN1 O00255 2/20 0.36
TSHR P16473 3/20 0.35
SMN1; SMN2 Q16637 1/20 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
SCHEMBL31361717 0.84 ACHE (0.35) ADORA2AADORA1KMT2ARAB9ANPC1
SCHEMBL31361696 0.84 ACHE (0.35) ADORA2AADORA1KMT2ARAB9ANPC1
SCHEMBL12460196 0.84 ACHE (0.38) HPGDRAB9AKDM4ENPC1ACHE
SCHEMBL16532142 0.81 FPR2 (0.41) KMT2AHPGDRAB9AKDM4ENPC1
SCHEMBL29427432 0.81 KDM4E (0.43) KMT2ARAB9AKDM4ENPC1LMNA
SCHEMBL19020973 0.78 SYK (0.39) ADORA2AADORA1KMT2AACHEMEN1
SCHEMBL15650220 0.78 ALDH1A1 (0.40) ADORA2AADORA1KDM4EACHEALDH1A1
SCHEMBL15564730 0.77 HPGD (0.42) KMT2AHPGDLMNACYP1A2CYP3A4
SCHEMBL26078457 0.77 SMN1; SMN2 (0.53) KMT2ARAB9ANPC1LMNACYP1A2
SCHEMBL17076750 0.74 CCNC (0.46) ADORA2AADORA1ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230312589-A1 JAK INHIBITORS VIMALAN BIOSCIENCES, INC. 2023-10-05 US disclosed
WO-2021026465-A1 JAK INHIBITORS VIMALAN BIOSCIENCES, INC. (US) 2021-02-11 WO disclosed
WO-2020227563-A1 JAK INHIBITORS VIMALAN BIOSCIENCES, INC. (US) 2020-11-12 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-20230312589-A1 JAK INHIBITORS JAK2, JAK1, JAK3 ADORA3 4117/4885ADORA2A 3579/4885ADORA1 4288/4885

“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.