SCHEMBL22722665

SCHEMBL22722665

CC(C)c1nc(-c2ccccc2)c2c(n1)C1CCN2CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CKS1B P61024 2/20 0.39
SKP1 P63208 2/20 0.39
SKP2 Q13309 2/20 0.39
NPSR1 Q6W5P4 3/20 0.37
HTT P42858 1/20 0.37
ALDH1A1 P00352 3/20 0.36
HPGD P15428 3/20 0.36
KDM4E B2RXH2 3/20 0.36
TSHR P16473 2/20 0.36
HSD17B10 Q99714 1/20 0.36
NPY5R Q15761 1/20 0.36
CNR2 P34972 1/20 0.36
MAPT P10636 2/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
DHFR P00374 1/20 0.34
SLC9A1 P19634 2/20 0.34
KIT P10721 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
AKT1 P31749 1/20 0.34

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
SCHEMBL13639525 0.82 CKS1B (0.42) CKS1BSKP1SKP2NPSR1HTT
SCHEMBL22694441 0.80 ALDH1A1 (0.46) CKS1BSKP1SKP2NPSR1HTT
SCHEMBL12677181 0.78 CKS1B (0.42) CKS1BSKP1SKP2NPSR1HTT
SCHEMBL12670578 0.78 CNR2 (0.40) CKS1BSKP1SKP2NPSR1HTT
SCHEMBL22694387 0.76 ALDH1A1 (0.40) CKS1BSKP1SKP2NPSR1HTT
SCHEMBL22694425 0.76 PDE10A (0.39) CKS1BSKP1SKP2KDM4ETSHR
SCHEMBL14700230 0.75 SLC9A1 (0.38) NPSR1ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL12309910 0.69 HPGD (0.45) HTTALDH1A1HPGDKDM4ETSHR
SCHEMBL1330773 0.68 SLC9A1 (0.39) ALDH1A1HPGDKDM4ETSHRHSD17B10
SCHEMBL23370555 0.67 KDM4E (0.46) NPSR1HTTALDH1A1HPGDKDM4E

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-20210078990-A1 TYROSINE KINASE INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2021-03-18 US disclosed
US-10851093-B2 Tyrosine kinase inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2020-12-01 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-10851093-B2 Tyrosine kinase inhibitors TYRO3, RET, AXL CKS1B 424/4885SKP1 632/4885SKP2 1059/4885
US-20210078990-A1 TYROSINE KINASE INHIBITORS TYRO3, RET, AXL CKS1B 424/4885SKP1 632/4885SKP2 1059/4885

“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.