SCHEMBL11949259

SCHEMBL11949259

CCN(C)C(=O)c1cccc(NS(C)(=O)=O)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.61
▸ ALDH1A1 P00352 1/20 0.61
▸ POLB P06746 1/20 0.58
▸ HTT P42858 1/20 0.50
▸ HPGD P15428 2/20 0.49
▸ LIMK2 P53671 2/20 0.46
▸ LIMK1 P53667 1/20 0.46
▸ NR3C2 P08235 2/20 0.45
▸ NR3C1 P04150 2/20 0.45
▸ PGR P06401 1/20 0.45
▸ AR P10275 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ TP53 P04637 2/20 0.43
▸ F2 P00734 1/20 0.43
▸ PRMT5 O14744 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ CYP3A4 P08684 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
SCHEMBL28028689 0.85 SMN1; SMN2 (0.69) SMN1; SMN2ALDH1A1POLBHTTHPGD
SCHEMBL754989 0.79 ALDH1A1 (0.69) SMN1; SMN2ALDH1A1POLBHTTHPGD
SCHEMBL334530 0.77 ALDH1A1 (1.00) SMN1; SMN2ALDH1A1POLBHTTHPGD
SCHEMBL1677059 0.77 ALDH1A1 (0.75) SMN1; SMN2ALDH1A1POLBHPGDMEN1
SCHEMBL29522198 0.77 ALDH1A1 (0.75) SMN1; SMN2ALDH1A1POLBHPGDMEN1
SCHEMBL11949257 0.77 SMN1; SMN2 (0.65) SMN1; SMN2ALDH1A1POLBHTTHPGD
SCHEMBL8563551 0.76 ALDH1A1 (0.69) SMN1; SMN2ALDH1A1POLBHTTHPGD
SCHEMBL29398556 0.76 ALDH1A1 (0.69) SMN1; SMN2ALDH1A1POLBHTTHPGD
SCHEMBL3560486 0.75 POLB (0.73) SMN1; SMN2ALDH1A1POLBHPGDMEN1
SCHEMBL2858017 0.75 ALDH1A1 (0.73) SMN1; SMN2ALDH1A1POLBHTTHPGD

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-8232271-B2 Heterocyclic antiviral compounds ROCHE PALO ALTO LLC (US) 2012-07-31 — — US disclosed
US-20100111900-A1 HETEROCYCLIC ANTIVIRAL COMPOUNDS ROCHE PALO ALTO LLC 2010-05-06 — — 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-20100111900-A1 HETEROCYCLIC ANTIVIRAL COMPOUNDS POLR2A, EIF2AK2, POLR2B SMN1; SMN2 3646/4885ALDH1A1 861/4885POLB 16/4885

“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.

Send feedback