SCHEMBL3488484

SCHEMBL3488484

OCCNc1nc(-c2ccccc2)c2cc(Cl)ccc2n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 1.00
SMN1; SMN2 Q16637 4/20 1.00
L3MBTL1 Q9Y468 2/20 1.00
KDM4E B2RXH2 6/20 0.73
HPGD P15428 4/20 0.73
MAPK1 P28482 2/20 0.73
CASP1 P29466 2/20 0.73
CASP7 P55210 2/20 0.73
RAB9A P51151 1/20 0.73
HSD17B10 Q99714 1/20 0.73
GAA P10253 5/20 0.71
GLA P06280 1/20 0.71
MAPT P10636 4/20 0.65
KMT2A Q03164 2/20 0.62
ATM Q13315 1/20 0.62
TP53 P04637 2/20 0.62
ADORA1 P30542 2/20 0.60
CRHBP P24387 2/20 0.55
CRHR2 Q13324 2/20 0.55
RXFP1 Q9HBX9 1/20 0.55

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
SCHEMBL21641647 0.92 ALDH1A1 (0.86) ALDH1A1SMN1; SMN2L3MBTL1KDM4EHPGD
SCHEMBL3486042 0.87 ALDH1A1 (0.77) ALDH1A1SMN1; SMN2L3MBTL1KDM4EHPGD
SCHEMBL3486858 0.86 ALDH1A1 (0.75) ALDH1A1SMN1; SMN2L3MBTL1KDM4EHPGD
SCHEMBL31218561 0.82 ALDH1A1 (0.69) ALDH1A1SMN1; SMN2L3MBTL1KDM4EHPGD
SCHEMBL3486899 0.81 ALDH1A1 (0.68) ALDH1A1SMN1; SMN2L3MBTL1KDM4EHPGD
SCHEMBL11704650 0.79 MAPT (1.00) ALDH1A1SMN1; SMN2L3MBTL1KDM4EMAPK1
SCHEMBL11708510 0.79 GAA (0.72) ALDH1A1SMN1; SMN2L3MBTL1KDM4EHPGD
SCHEMBL11436371 0.78 ALDH1A1 (0.63) ALDH1A1SMN1; SMN2L3MBTL1KDM4EHPGD
SCHEMBL3486902 0.78 ALDH1A1 (0.63) ALDH1A1SMN1; SMN2L3MBTL1KDM4EMAPK1
SCHEMBL3487128 0.77 ALDH1A1 (0.61) ALDH1A1SMN1; SMN2L3MBTL1KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2100507-B1 QUINAZOLINE DERIVATIVES CAPABLE OF INHIBITING CYTOKININ SIGNALING SUMITOMO CHEMICAL CO (JP) 2015-02-25 EP disclosed
US-8722580-B2 Agent for inhibiting cytokinin signaling SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-05-13 US disclosed
US-20100056377-A1 AGENT FOR INHIBITING CYTOKININ SIGNALING SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-04 US disclosed
CN-101588716-A Substance capable of inhibiting cytokinin signaling SUMITOMO CHEMICAL CO (JP) 2009-11-25 CN disclosed
EP-2100507-A1 SUBSTANCE CAPABLE OF INHIBITING CYTOKININ SIGNALING Sumitomo Chemical Company, Limited (JP) 2009-09-16 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-20100056377-A1 AGENT FOR INHIBITING CYTOKININ SIGNALING CROCC, STAT3, GRK6 ALDH1A1 2316/4885SMN1; SMN2 4884/4885L3MBTL1 4299/4885

“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.