SCHEMBL21668008

SCHEMBL21668008

CC(C)c1cn(-c2cccc(Cl)c2)cn1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM2B Q8NHM5 1/20 0.48
PHF8 Q9UPP1 1/20 0.48
KDM2A Q9Y2K7 1/20 0.48
IDO1 P14902 1/20 0.47
MGLL Q99685 1/20 0.41
FGFR1 P11362 1/20 0.41
HCAR1 Q9BXC0 1/20 0.38
NOTUM Q6P988 1/20 0.37
KDM4E B2RXH2 2/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
IDH1 O75874 1/20 0.37

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
SCHEMBL20677088 0.88 KDM2B (0.46) KDM2BPHF8KDM2AIDO1MGLL
SCHEMBL27661890 0.88 KDM2B (0.46) KDM2BPHF8KDM2AIDO1MGLL
SCHEMBL19402169 0.88 KDM2B (0.46) KDM2BPHF8KDM2AIDO1MGLL
SCHEMBL21668010 0.80 MAP4K4 (0.42) PHF8NOTUMIDH1
SCHEMBL22185889 0.80 ALDH1A1 (0.46) MGLLFGFR1NOTUMMAPT
SCHEMBL12443627 0.80 CYP2E1 (0.42) GAA
SCHEMBL944327 0.80 PARP1 (0.48) FGFR1GAA
SCHEMBL25590434 0.79 GRM5 (0.59) NOTUMKDM4EMAPT
SCHEMBL12146179 0.79 KDM2B (0.55) KDM2BPHF8KDM2AIDO1FGFR1
SCHEMBL27681837 0.78 TSHR (0.42) KDM2BPHF8KDM2AIDO1NOTUM

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-20200206233-A1 HETEROCYCLIC COMPOUNDS AS MUTANT IDH INHIBITORS INTEGRAL BIOSCIENCES PRIVATE LIMITED (IN) 2020-07-02 US disclosed
EP-3429355-B1 SUBSTITUTED SULFONYLAMIDE FOR COMBATING ANIMAL PESTS BAYER CROPSCIENCE AG (DE) 2020-02-05 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-20200206233-A1 HETEROCYCLIC COMPOUNDS AS MUTANT IDH INHIBITORS IDH1, IDH2, IDH3A KDM2B 505/4885PHF8 653/4885KDM2A 424/4885

“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.