SCHEMBL17134932

SCHEMBL17134932

CCOC(=O)c1cnc(S(N)(=O)=O)c(Cl)c1NC1(c2ccccc2)CC1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ AURKB Q96GD4 6/20 0.44
▸ AURKA O14965 3/20 0.44
▸ CA2 P00918 1/20 0.42
▸ MAPT P10636 2/20 0.40
▸ THRB P10828 1/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ PKM P14618 1/20 0.39
▸ PDE4B Q07343 2/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ ADORA1 P30542 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
SCHEMBL17135291 0.92 MAPT (0.40) AURKBAURKAMAPTTHRBALDH1A1
SCHEMBL17134509 0.87 MAPT (0.43) MAPTTHRBALDH1A1MEN1KMT2A
SCHEMBL17134826 0.85 VNN1 (0.43) —
SCHEMBL17134640 0.85 MAPT (0.42) MAPTTHRBALDH1A1MEN1KMT2A
SCHEMBL17135004 0.78 AURKB (0.41) AURKBAURKACA2MAPTALDH1A1
SCHEMBL17184284 0.75 CA12 (0.45) CA2ALDH1A1
SCHEMBL17134703 0.74 SCD5 (0.39) CA2ALDH1A1SMN1; SMN2
SCHEMBL17135080 0.74 AURKB (0.62) AURKBAURKACA2MAPTALDH1A1
SCHEMBL913700 0.73 ALDH1A1 (0.58) MAPTALDH1A1MEN1KMT2ARAB9A
SCHEMBL17134949 0.72 NPSR1 (0.57) AURKBAURKAMAPTTHRBALDH1A1

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
EP-2927214-B1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND KYOWA HAKKO KIRIN CO LTD (JP) 2018-03-21 — — EP disclosed
US-9701689-B2 Substituted pyridines and pyridazines as CCR10 receptor inhibitors KYOWA HAKKO KIRIN CO., LTD. (JP) 2017-07-11 — — US disclosed
US-20150299214-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND KYOWA HAKKO KIRIN CO., LTD. (JP) 2015-10-22 — — US disclosed
EP-2927214-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND Kyowa Hakko Kirin Co., Ltd. (JP) 2015-10-07 — — 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-20150299214-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND ARG1, H1-0, TYR AURKB 4438/4885AURKA 3400/4885CA2 1307/4885

“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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