SCHEMBL23524008

SCHEMBL23524008

Cc1nc(-c2ccccc2)oc1-c1cnc2c(c1)CC(=O)N2

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 2/20 0.66
CHEK1 O14757 1/20 0.66
AURKA O14965 1/20 0.66
DAPK3 O43293 1/20 0.66
PRKD3 O94806 1/20 0.66
MAP4K4 O95819 1/20 0.66
NTRK1 P04629 1/20 0.66
CSF1R P07333 1/20 0.66
RET P07949 1/20 0.66
MET P08581 1/20 0.66
PDGFRB P09619 1/20 0.66
PIM1 P11309 1/20 0.66
FGFR1 P11362 1/20 0.66
PDGFRA P16234 1/20 0.66
FLT1 P17948 1/20 0.66
LTK P29376 1/20 0.66
GRK5 P34947 1/20 0.66
KDR P35968 1/20 0.66
MAP2K2 P36507 1/20 0.66
FLT3 P36888 1/20 0.66

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
SCHEMBL16090319 0.82 GRIA1 (0.53) ABL1CHEK1AURKADAPK3PRKD3
SCHEMBL5873863 0.81 KDR (1.00) ABL1CHEK1AURKADAPK3PRKD3
SCHEMBL16090320 0.80 CRBN (0.45) ABL1CHEK1AURKADAPK3PRKD3
SCHEMBL16090345 0.73 CDK5 (0.67) ABL1CHEK1AURKADAPK3PRKD3
SCHEMBL869242 0.72 GAA (0.51) GAAUSP1USP19WDR48ELANE
SCHEMBL30239369 0.71 LRRK2 (0.68) ABL1CHEK1AURKADAPK3PRKD3
SCHEMBL13854137 0.71 ABL1 (0.74) ABL1CHEK1AURKADAPK3PRKD3
SCHEMBL272772 0.70 NPC1 (0.50) GAAUSP1USP19WDR48ELANE
SCHEMBL3141083 0.70 ABL1 (0.76) ABL1CHEK1AURKADAPK3PRKD3
SCHEMBL5873962 0.70 ABL1 (0.67) ABL1CHEK1AURKADAPK3PRKD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11912693-B2 Compounds for modulating S1P1 activity and methods of using the same TREVENA, INC. (US) 2024-02-27 US disclosed
US-11912693-B2 Compounds for modulating S1P1 activity and methods of using the same TREVENA, INC. (US) 2024-02-27 US disclosed
US-11912693-B2 Compounds for modulating S1P1 activity and methods of using the same TREVENA, INC. (US) 2024-02-27 US disclosed
US-20230234946-A1 COMPOUNDS FOR MODULATING S1P1 ACTIVITY AND METHODS OF USING THE SAME TREVENA, INC. 2023-07-27 US disclosed
US-20230234946-A1 COMPOUNDS FOR MODULATING S1P1 ACTIVITY AND METHODS OF USING THE SAME TREVENA, INC. 2023-07-27 US disclosed
US-20230234946-A1 COMPOUNDS FOR MODULATING S1P1 ACTIVITY AND METHODS OF USING THE SAME TREVENA, INC. 2023-07-27 US disclosed
US-20230114241-A1 METHODS OF TREATING EPILEPSY USING THE SAME TREVENA, INC. 2023-04-13 US disclosed
US-20210188826-A1 COMPOUNDS FOR MODULATING S1P1 ACTIVITY AND METHODS OF USING THE SAME TREVENA, INC. 2021-06-24 US disclosed
US-20210188826-A1 COMPOUNDS FOR MODULATING S1P1 ACTIVITY AND METHODS OF USING THE SAME TREVENA, INC. 2021-06-24 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 (4 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-20230234946-A1 COMPOUNDS FOR MODULATING S1P1 ACTIVITY AND METHODS OF USING THE SAME S1PR1, S1PR2, S1PR3 ABL1 1585/4885CHEK1 3053/4885AURKA 2089/4885
US-20230114241-A1 METHODS OF TREATING EPILEPSY USING THE SAME S1PR1, S1PR2, S1PR3 ABL1 3841/4885CHEK1 4607/4885AURKA 3919/4885
US-11912693-B2 Compounds for modulating S1P1 activity and methods of using the same S1PR1, S1PR2, S1PR3 ABL1 1585/4885CHEK1 3053/4885AURKA 2089/4885
US-20210188826-A1 COMPOUNDS FOR MODULATING S1P1 ACTIVITY AND METHODS OF USING THE SAME S1PR1, S1PR2, S1PR3 ABL1 1585/4885CHEK1 3053/4885AURKA 2089/4885

“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.