SCHEMBL20360734

SCHEMBL20360734

O=C1N/C(=N/c2ccccc2)CS1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 1.00
▸ L3MBTL1 Q9Y468 1/20 1.00
▸ MAPT P10636 4/20 0.72
▸ ALDH1A1 P00352 3/20 0.72
▸ KMT2A Q03164 5/20 0.44
▸ MEN1 O00255 4/20 0.44
▸ GAA P10253 3/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ NPC1 O15118 3/20 0.41
▸ HPGD P15428 2/20 0.40
▸ PKM P14618 1/20 0.40
▸ ADORA2A P29274 1/20 0.40
▸ GSK3B P49841 3/20 0.39
▸ MGAM O43451 1/20 0.39
▸ SI P14410 1/20 0.39
▸ GSK3A P49840 1/20 0.39
▸ MGAM2 Q2M2H8 1/20 0.39

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
SCHEMBL20360735 1.00 ATM (1.00) ATML3MBTL1MAPTALDH1A1KMT2A
SCHEMBL4141640 0.70 HPGD (0.70) ATML3MBTL1MAPTALDH1A1KMT2A
SCHEMBL4141641 0.70 HPGD (0.70) ATML3MBTL1MAPTALDH1A1KMT2A
SCHEMBL10176120 0.70 HPGD (0.70) ATML3MBTL1MAPTALDH1A1KMT2A
SCHEMBL10971029 0.67 — —
SCHEMBL10971028 0.67 — —
Biphenyl SCHEMBL3790238 0.67 GSK3A (0.67) ATML3MBTL1ALDH1A1GAAHPGD
SCHEMBL3224077 0.66 ATM (0.48) ATML3MBTL1MAPTALDH1A1KMT2A
SCHEMBL3224073 0.66 ATM (0.48) ATML3MBTL1MAPTALDH1A1KMT2A
SCHEMBL29961030 0.63 AHR (0.50) ATML3MBTL1MAPTALDH1A1KMT2A

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-20190352297-A1 SELECTIVE AURORA A KINASE INHIBITORS UNIVERSITAT BERN (CH) 2019-11-21 — — US disclosed
WO-2018127292-A1 SELECTIVE AURORA A KINASE INHIBITORS Universität Bern (CH) 2018-07-12 — — WO 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-20190352297-A1 SELECTIVE AURORA A KINASE INHIBITORS AURKC, AURKA, AURKB ATM 350/4885L3MBTL1 398/4885MAPT 2334/4885

“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.

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