SCHEMBL8738488

SCHEMBL8738488

O=C(O)c1cnc(O)nc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.46
NFE2L2 Q16236 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.42
LMNA P02545 1/20 0.42
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.38
HPGD P15428 2/20 0.38
CRHBP P24387 1/20 0.38
CRHR2 Q13324 1/20 0.38
HAVCR2 Q8TDQ0 1/20 0.37
GABRP O00591 2/20 0.36
GABRD O14764 2/20 0.36
GABRA1 P14867 2/20 0.36
GABRB1 P18505 2/20 0.36
GABRG2 P18507 2/20 0.36
GABRB3 P28472 2/20 0.36
GABRA5 P31644 2/20 0.36
GABRA3 P34903 2/20 0.36
GABRA2 P47869 2/20 0.36
GABRB2 P47870 2/20 0.36

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
SCHEMBL721758 0.81 KEAP1 (0.47) KEAP1NFE2L2SMN1; SMN2LMNAKMT2A
Hydrochloric Acid SCHEMBL7754141 0.79 KEAP1 (0.46) KEAP1NFE2L2SMN1; SMN2LMNAKMT2A
SCHEMBL14637332 0.79 KEAP1 (0.46) KEAP1NFE2L2SMN1; SMN2LMNAKMT2A
SCHEMBL152156 0.78 HPGD (0.40) SMN1; SMN2KMT2AMEN1HPGDGABRP
SCHEMBL4274478 0.78 HPGD (0.44) KEAP1NFE2L2SMN1; SMN2LMNAKMT2A
Ethylene SCHEMBL29153723 0.78 NFKB1 (0.44) KEAP1NFE2L2SMN1; SMN2LMNAKMT2A
Water SCHEMBL2745045 0.77 HPGD (0.39) SMN1; SMN2KMT2AMEN1HPGDGABRP
Hydrochloric Acid SCHEMBL11591950 0.77 HPGD (0.39) SMN1; SMN2KMT2AMEN1HPGDGABRP
Hydrochloric Acid SCHEMBL10585295 0.76 HPGD (0.43) KEAP1NFE2L2SMN1; SMN2LMNAKMT2A
SCHEMBL6517817 0.75 GABRP (0.44) SMN1; SMN2KMT2AMEN1HPGDHAVCR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180155297-A1 INHIBITORS OF ACK1/TNK2 TYROSINE KINASE H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. 2018-06-07 US disclosed
US-20180155297-A1 INHIBITORS OF ACK1/TNK2 TYROSINE KINASE H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. 2018-06-07 US disclosed
US-8318755-B2 Inhibitors of SYK and JAK protein kinases PORTOLA PHARMACEUTICALS, INC. (US) 2012-11-27 US disclosed
US-8318755-B2 Inhibitors of SYK and JAK protein kinases PORTOLA PHARMACEUTICALS, INC. (US) 2012-11-27 US disclosed
US-20120130073-A1 INHIBITORS OF SYK AND JAK PROTEIN KINASES PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-24 US disclosed
US-20120130073-A1 INHIBITORS OF SYK AND JAK PROTEIN KINASES PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-24 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 (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-20120130073-A1 INHIBITORS OF SYK AND JAK PROTEIN KINASES SYK, BTK, JAK1 KEAP1 3382/4885NFE2L2 3995/4885SMN1; SMN2 4341/4885
US-20180155297-A1 INHIBITORS OF ACK1/TNK2 TYROSINE KINASE TNK1, TNNI3K, TNK2 KEAP1 3205/4885NFE2L2 2491/4885SMN1; SMN2 4207/4885

“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.