SCHEMBL2394597

SCHEMBL2394597

O=C(Nc1cc[nH]n1)N(S)C(=O)c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCNA2 P20248 3/20 0.35
▸ CDK2 P24941 3/20 0.35
▸ CCNA1 P78396 3/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ RAB9A P51151 3/20 0.35
▸ NPC1 O15118 2/20 0.35
▸ SMN1; SMN2 Q16637 3/20 0.34
▸ HPGD P15428 3/20 0.34
▸ TDP1 Q9NUW8 2/20 0.34
▸ CYP3A4 P08684 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ CES1 P23141 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ CYP1A2 P05177 2/20 0.33
▸ CYP2C9 P11712 2/20 0.33
▸ F2 P00734 2/20 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
SCHEMBL696662 0.78 KMT2A (0.58) CCNA2CDK2CCNA1KMT2AMEN1
SCHEMBL14859165 0.76 ALDH1A1 (0.51) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL2862569 0.72 RAB9A (0.59) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL3064600 0.71 — —
SCHEMBL14859656 0.71 F2 (0.50) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL2394596 0.71 NPC1 (0.61) KMT2AMEN1RAB9ANPC1HPGD
SCHEMBL3420646 0.71 SMN1; SMN2 (0.51) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL13038790 0.70 SMN1; SMN2 (0.59) KMT2AMEN1RAB9ANPC1SMN1; SMN2
Hydrochloric Acid SCHEMBL4794455 0.70 CCNA2 (0.34) CCNA2CDK2CCNA1KMT2ARAB9A
SCHEMBL3420311 0.70 NPC1 (0.59) KMT2AMEN1RAB9ANPC1SMN1; SMN2

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
US-8017608-B2 5-Phenylthiazole derivatives and their use as p13 kinase inhibitors NOVARTIS AG (CH) 2011-09-13 — — US disclosed
EP-1608647-B1 5-PHENYLTHIAZOLE DERIVATIVES AND THEIR USE AS P13 KINASE INHIBITORS NOVARTIS AG (CH) 2008-01-09 — — EP disclosed
US-20060148822-A1 5-Phenylthiazole derivatives and their use as p13 kinase inhibitors NOVARTIS AG (CH) 2006-07-06 — — US disclosed
EP-1608647-A1 5-PHENYLTHIAZOLE DERIVATIVES AND THEIR USE AS P13 KINASE INHIBITORS Novartis AG (CH) 2005-12-28 — — EP disclosed
WO-2004078754-A1 5-PHENYLTHIAZOLE DERIVATIVES AND THEIR USE AS P13 KINASE INHIBITORS NOVARTIS AG (CH) 2004-09-16 — — 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-20060148822-A1 5-Phenylthiazole derivatives and their use as p13 kinase inhibitors MAP3K13, AKT3, MAP3K3 CCNA2 751/4885CDK2 60/4885CCNA1 565/4885

“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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