SCHEMBL21187940

SCHEMBL21187940

CC(C)(C)OC(=O)N1C(CON)COC1(C)C

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 1/20 0.47
HSD11B2 P80365 1/20 0.37
BRD4 O60885 1/20 0.37
CHRM2 P08172 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
HCRTR2 O43614 1/20 0.34
USP2 O75604 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NR1H2 P55055 1/20 0.32
NAMPT P43490 1/20 0.31
DDB1 Q16531 1/20 0.30
CRBN Q96SW2 1/20 0.30
RECQL P46063 1/20 0.30
CTSK P43235 1/20 0.30

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
SCHEMBL12767436 1.00 SPHK1 (0.47) SPHK1HSD11B2BRD4CHRM2CHRM1
SCHEMBL16421029 0.88 SPHK1 (0.46) SPHK1HSD11B2BRD4CHRM2CHRM1
SCHEMBL15209132 0.87 SPHK1 (0.48) SPHK1HSD11B2BRD4CHRM2CHRM1
SCHEMBL15209134 0.87 SPHK1 (0.48) SPHK1HSD11B2BRD4CHRM2CHRM1
SCHEMBL17244141 0.86 SPHK1 (0.48) SPHK1HSD11B2BRD4CHRM2CHRM1
SCHEMBL14704757 0.86 SPHK1 (0.49) SPHK1HSD11B2BRD4CHRM2CHRM1
SCHEMBL13110172 0.86 SPHK1 (0.49) SPHK1HSD11B2BRD4CHRM2CHRM1
SCHEMBL5063645 0.86 SPHK1 (0.49) SPHK1HSD11B2BRD4CHRM2CHRM1
SCHEMBL1526136 0.84 SPHK1 (0.50) SPHK1HSD11B2BRD4CHRM2CHRM1
SCHEMBL20621505 0.84 SPHK1 (0.53) SPHK1HSD11B2BRD4CHRM2CHRM1

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-11214554-B2 Indoleamine 2,3-dioxygenase inhibitor, method for preparation and use thereof NANJING HUAWE MEDICINE TECHNOLOGY GROUP CO., LTD. (CN) 2022-01-04 US disclosed
US-20210094924-A1 INDOLEAMINE 2,3-DIOXYGENASE INHIBITOR, METHOD FOR PREPARATION AND USE THEREOF NANJING HUAWE MEDICINE TECHNOLOGY GROUP CO., LTD. (CN) 2021-04-01 US disclosed
WO-2019141027-A1 INDOLEAMINE 2,3-DIOXYGENASE INHIBITOR, PREPARATION METHOD THEREOF AND USE THEREOF 南京华威医药科技集团有限公司 2019-07-25 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-20210094924-A1 INDOLEAMINE 2,3-DIOXYGENASE INHIBITOR, METHOD FOR PREPARATION AND USE THEREOF IDO1, IDO2, KYNU SPHK1 2792/4885HSD11B2 247/4885BRD4 2905/4885
US-11214554-B2 Indoleamine 2,3-dioxygenase inhibitor, method for preparation and use thereof IDO1, IDO2, KYNU SPHK1 2021/4885HSD11B2 162/4885BRD4 2859/4885

“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.