SCHEMBL16088363

SCHEMBL16088363

CCOC(=O)CN1N=C(c2ccc(Br)cc2)CC1c1cccc(Cl)c1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 3/20 0.53
▸ MAOB P27338 3/20 0.53
▸ PRKCZ Q05513 1/20 0.49
▸ CA12 O43570 3/20 0.48
▸ CA1 P00915 3/20 0.48
▸ CA2 P00918 3/20 0.48
▸ CA9 Q16790 3/20 0.48
▸ BCL2 P10415 2/20 0.47
▸ KIF11 P52732 1/20 0.44
▸ RNF114 Q9Y508 1/20 0.43
▸ ATM Q13315 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ EGFR P00533 1/20 0.42
▸ ACHE P22303 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.42

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
SCHEMBL15987950 0.86 PRKCZ (0.55) MAOAMAOBPRKCZCA12CA1
SCHEMBL5058846 0.81 L3MBTL1 (0.59) MAOAMAOBL3MBTL1KDM4E
SCHEMBL17554565 0.78 MAOA (0.58) MAOAMAOBPRKCZCA12CA1
SCHEMBL25274761 0.76 KIF11 (0.53) MAOAMAOBPRKCZCA12CA1
SCHEMBL26508543 0.72 KDM4E (0.52) MAOAMAOBCA12CA1CA2
SCHEMBL16088364 0.69 TSHR (0.57) KDM4E
SCHEMBL18918345 0.66 LMNA (0.54) L3MBTL1KDM4E
SCHEMBL27936553 0.65 CACNA1H (0.64) MAOAMAOBRNF114ACHEKDM4E
SCHEMBL17504154 0.65 LMNA (0.50) L3MBTL1
SCHEMBL26508522 0.65 SMN1; SMN2 (0.45) L3MBTL1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9522914-B2 Azole derivative TAISHO PHARMACEUTICAL CO., LTD (JP) 2016-12-20 — — US disclosed
US-9522914-B2 Azole derivative TAISHO PHARMACEUTICAL CO., LTD (JP) 2016-12-20 — — US disclosed
US-20140275006-A1 AZOLE DERIVATIVE TAISHO PHARMACEUTICAL CO., LTD (JP) 2014-09-18 — — US disclosed
US-20140275006-A1 AZOLE DERIVATIVE TAISHO PHARMACEUTICAL CO., LTD (JP) 2014-09-18 — — 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 (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-20140275006-A1 AZOLE DERIVATIVE AVPR1B, AVPR1A, AVPR2 MAOA 496/4885MAOB 145/4885PRKCZ 2136/4885

“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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