SCHEMBL5408184

SCHEMBL5408184

CSc1c(O)ccc2[nH]ncc12

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 1/20 0.40
▸ NOS1 P29475 4/20 0.38
▸ AXL P30530 2/20 0.38
▸ FGFR1 P11362 2/20 0.37
▸ P4HB P07237 5/20 0.36
▸ CCNA2 P20248 1/20 0.36
▸ CDK2 P24941 1/20 0.36
▸ CCNA1 P78396 1/20 0.36
▸ METAP2 P50579 1/20 0.35
▸ JAK2 O60674 2/20 0.34
▸ JAK1 P23458 2/20 0.34
▸ FGFR2 P21802 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ TYK2 P29597 1/20 0.33
▸ JAK3 P52333 1/20 0.33

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
SCHEMBL5412894 0.83 SMN1; SMN2 (0.38) IDO1NOS1AXLFGFR1P4HB
SCHEMBL25808844 0.80 ESR1 (0.41) IDO1NOS1AXLCCNA2CDK2
SCHEMBL24343555 0.79 IDO1 (0.40) IDO1NOS1AXLCCNA2CDK2
SCHEMBL5404343 0.76 FGFR1 (0.44) IDO1NOS1AXLFGFR1P4HB
SCHEMBL21437262 0.75 NOS1 (0.44) IDO1NOS1AXLFGFR1P4HB
SCHEMBL5412653 0.72 NOS1 (0.50) IDO1NOS1AXLFGFR1P4HB
SCHEMBL5421701 0.72 TRPA1 (0.47) IDO1NOS1AXLFGFR1P4HB
SCHEMBL5413400 0.72 NOS1 (0.50) IDO1NOS1AXLFGFR1P4HB
SCHEMBL31740241 0.72 TRPA1 (0.47) IDO1NOS1AXLFGFR1P4HB
SCHEMBL5401942 0.71 CDK2 (0.40) IDO1NOS1AXLFGFR1P4HB

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-7199147-B2 Rho kinase inhibitors DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-04-03 — — US disclosed
US-20040138286-A1 Rho kinase inhibitors DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2004-07-15 — — US disclosed
EP-1403255-A1 Rho KINASE INHIBITORS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2004-03-31 — — EP 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-20040138286-A1 Rho kinase inhibitors ROCK1, ROCK2, ARHGDIA IDO1 2940/4885NOS1 131/4885AXL 1805/4885

“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.

Send feedback