SCHEMBL3208468

SCHEMBL3208468

N#CCCNC(=O)c1cccc(-c2cccc3nn(Cc4cc(F)cc(Cl)c4)cc23)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 5/20 0.57
ADORA3 P0DMS8 1/20 0.38
ADORA2B P29275 1/20 0.38
MAPT P10636 1/20 0.38
PRKD1 Q15139 1/20 0.37
AURKA O14965 1/20 0.36
ADORA2A P29274 1/20 0.35
SNCA P37840 3/20 0.35
KISS1R Q969F8 3/20 0.35
CTSV O60911 1/20 0.34
CTSL P07711 1/20 0.34
CTSB P07858 1/20 0.34
CTSS P25774 1/20 0.34
CTSK P43235 1/20 0.34
HDAC3 O15379 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC10 Q969S8 1/20 0.34

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
SCHEMBL1850719 0.91 GPR52 (0.61) GPR52ADORA3ADORA2BMAPTPRKD1
SCHEMBL1850771 0.90 GPR52 (0.64) GPR52ADORA3ADORA2BPRKD1AURKA
SCHEMBL1848382 0.90 GPR52 (0.62) GPR52ADORA3ADORA2BMAPTPRKD1
SCHEMBL3209129 0.90 GPR52 (0.69) GPR52ADORA3ADORA2BAURKA
SCHEMBL1851340 0.89 GPR52 (0.59) GPR52ADORA3ADORA2BMAPTPRKD1
SCHEMBL3206870 0.88 GPR52 (0.63) GPR52ADORA3ADORA2BMAPTPRKD1
SCHEMBL3217408 0.88 GPR52 (0.61) GPR52ADORA3ADORA2BMAPTPRKD1
SCHEMBL1851055 0.87 GPR52 (0.65) GPR52ADORA3ADORA2BADORA2A
SCHEMBL1851052 0.86 GPR52 (0.58) GPR52ADORA3ADORA2BMAPTAURKA
SCHEMBL1848441 0.84 GPR52 (0.50) GPR52ADORA3ADORA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100041891-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-18 US disclosed
US-20100041891-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-18 US disclosed
US-20100041891-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-18 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-20100041891-A1 AMIDE COMPOUND GPR52, GPR132, NR5A2 GPR52 1/4885ADORA3 591/4885ADORA2B 442/4885

“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.