SCHEMBL5095308

SCHEMBL5095308

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nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 1/20 0.38
▸ VDR P11473 1/20 0.38
▸ SLC6A12 P48065 5/20 0.36
▸ SLC6A11 P48066 5/20 0.36
▸ SLC6A13 Q9NSD5 5/20 0.36
▸ SLC6A1 P30531 2/20 0.36
▸ GABRA5 P31644 2/20 0.36
▸ GABRB2 P47870 2/20 0.36
▸ GABRA1 P14867 1/20 0.36
▸ GABRR1 P24046 1/20 0.36
▸ GABRA4 P48169 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ POLB P06746 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ ANPEP P15144 1/20 0.35
▸ ENPEP Q07075 1/20 0.35
▸ CHRM2 P08172 3/20 0.34
▸ CHRM4 P08173 3/20 0.34
▸ CHRM1 P11229 3/20 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
SCHEMBL5095310 1.00 USP2 (0.38) USP2VDRSLC6A12SLC6A11SLC6A13
SCHEMBL5102184 0.85 CHRM2 (0.34) USP2VDRALDH1A1MAPTCHRM2
SCHEMBL5102182 0.85 CHRM2 (0.34) USP2VDRALDH1A1MAPTCHRM2
SCHEMBL4606719 0.85 CHRM2 (0.40) USP2VDRSLC6A12SLC6A11SLC6A13
SCHEMBL4607441 0.85 CHRM2 (0.40) USP2VDRSLC6A12SLC6A11SLC6A13
SCHEMBL4606721 0.85 CHRM2 (0.40) USP2VDRSLC6A12SLC6A11SLC6A13
SCHEMBL18844170 0.83 ALDH1A1 (0.33) SLC6A12SLC6A11SLC6A13SLC6A1GABRA5
SCHEMBL25069171 0.82 BRD4 (0.38) USP2VDRALDH1A1MAPTCHRM2
SCHEMBL20099504 0.81 SLC6A1 (0.33) SLC6A12SLC6A11SLC6A13SLC6A1GABRA5
SCHEMBL606928 0.79 SLC6A12 (0.37) SLC6A12SLC6A11SLC6A13SLC6A1GABRA5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7449461-B2 Benzathiazol-acetamides HOFFMANN-LA ROCHE INC. (US) 2008-11-11 — — US disclosed
US-20060019950-A1 Benzathiazol-acetamides F. HOFFMANN-LA ROCHE AG, A SWISS COMPANY (CH) 2006-01-26 — — 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-20060019950-A1 Benzathiazol-acetamides CHRNA2, CHRNA10, CHRNA5 USP2 3034/4885VDR 3629/4885SLC6A12 2616/4885

“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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