SCHEMBL3323359

SCHEMBL3323359

FC(F)(F)Oc1cccc(CN2CCC(Nc3nnc(C(F)(F)F)s3)CC2)c1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CXCR3 P49682 1/20 0.50
▸ CARM1 Q86X55 1/20 0.47
▸ PRMT6 Q96LA8 1/20 0.47
▸ ACHE P22303 3/20 0.46
▸ BCHE P06276 2/20 0.46
▸ BACE1 P56817 2/20 0.46
▸ OPRM1 P35372 1/20 0.46
▸ PKM P14618 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ CHRM4 P08173 2/20 0.45
▸ CHRM3 P20309 1/20 0.44
▸ MEN1 O00255 7/20 0.44
▸ KMT2A Q03164 7/20 0.44
▸ DRD4 P21917 1/20 0.42
▸ KCNN4 O15554 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
SCHEMBL27780878 0.90 CARM1 (0.50) CXCR3CARM1PRMT6MEN1KMT2A
SCHEMBL3321651 0.84 PKM (0.61) ACHEBCHEBACE1PKML3MBTL1
SCHEMBL3323699 0.81 DRD2 (0.62) CXCR3ACHEPKML3MBTL1MEN1
SCHEMBL3322725 0.79 MEN1 (0.50) ACHEBCHEBACE1PKML3MBTL1
SCHEMBL13361813 0.79 DRD2 (0.53) CXCR3ACHEPKML3MBTL1MEN1
SCHEMBL3323191 0.78 DRD2 (0.52) CXCR3ACHEPKML3MBTL1MEN1
SCHEMBL27780900 0.76 MEN1 (0.51) ACHEPKML3MBTL1MEN1KMT2A
SCHEMBL8143331 0.74 OPRM1 (0.57) CXCR3CARM1PRMT6ACHEBCHE
SCHEMBL3323404 0.73 SIGMAR1 (0.52) ACHEBCHEBACE1DRD4
SCHEMBL3321203 0.72 PKM (0.47) ACHEPKML3MBTL1CHRM4MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8933101-B2 Thia(dia)zoles as fast dissociating dopamine 2 receptor antagonists JANSSEN PHARMACEUTICA NV (BE) 2015-01-13 — — US claimed
US-20100120860-A1 THIA(DIA)ZOLES AS FAST DISSOCIATING DOPAMINE 2 RECEPTOR ANTAGONISTS JANSSEN-CILAG S.A., (ES) 2010-05-13 — — US claimed
US-8933101-B2 Thia(dia)zoles as fast dissociating dopamine 2 receptor antagonists JANSSEN PHARMACEUTICA NV (BE) 2015-01-13 — — US disclosed
US-8933101-B2 Thia(dia)zoles as fast dissociating dopamine 2 receptor antagonists JANSSEN PHARMACEUTICA NV (BE) 2015-01-13 — — US disclosed
US-8933101-B2 Thia(dia)zoles as fast dissociating dopamine 2 receptor antagonists JANSSEN PHARMACEUTICA NV (BE) 2015-01-13 — — US disclosed
US-20100120860-A1 THIA(DIA)ZOLES AS FAST DISSOCIATING DOPAMINE 2 RECEPTOR ANTAGONISTS JANSSEN-CILAG S.A., (ES) 2010-05-13 — — US disclosed
US-20100120860-A1 THIA(DIA)ZOLES AS FAST DISSOCIATING DOPAMINE 2 RECEPTOR ANTAGONISTS JANSSEN-CILAG S.A., (ES) 2010-05-13 — — US disclosed
US-20100120860-A1 THIA(DIA)ZOLES AS FAST DISSOCIATING DOPAMINE 2 RECEPTOR ANTAGONISTS JANSSEN-CILAG S.A., (ES) 2010-05-13 — — 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-20100120860-A1 THIA(DIA)ZOLES AS FAST DISSOCIATING DOPAMINE 2 RECEPTOR ANTAGONISTS GRIN2A, DRD2, GRIN2C CXCR3 3438/4885CARM1 3707/4885PRMT6 4445/4885

“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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