SCHEMBL10002001

SCHEMBL10002001

CS(=O)(=O)CCOCCNC(=O)c1ccsc1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.46
CA2 P00918 4/20 0.45
CA1 P00915 1/20 0.45
HDAC1 Q13547 3/20 0.43
KMT2A Q03164 1/20 0.42
HDAC3 O15379 2/20 0.41
MCHR1 Q99705 1/20 0.39
HPGD P15428 1/20 0.38
ITGAV P06756 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
CTSS P25774 1/20 0.37
ALDH1A1 P00352 1/20 0.37
KDM4E B2RXH2 1/20 0.37

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
SCHEMBL10001998 0.89 CA2 (0.43) SMN1; SMN2CA2CA1HDAC1KMT2A
SCHEMBL10002003 0.88 SMN1; SMN2 (0.47) SMN1; SMN2CA2CA1HDAC1KMT2A
SCHEMBL863060 0.83 SMN1; SMN2 (0.50) SMN1; SMN2CA2CA1HDAC1HDAC3
SCHEMBL864270 0.82 SMN1; SMN2 (0.47) SMN1; SMN2CA2CA1HDAC1KMT2A
SCHEMBL10001999 0.82 SMN1; SMN2 (0.51) SMN1; SMN2CA2CA1HDAC1HDAC3
SCHEMBL863113 0.81 SMN1; SMN2 (0.52) SMN1; SMN2HDAC1KMT2AHDAC3MCHR1
SCHEMBL8846821 0.74 MEN1 (0.56) SMN1; SMN2CA2CA1HDAC1KMT2A
SCHEMBL29205214 0.74 ALDH1A1 (0.50) SMN1; SMN2HDAC1KMT2AHDAC3MCHR1
SCHEMBL3641810 0.74 HDAC1 (0.56) SMN1; SMN2CA2CA1HDAC1KMT2A
SCHEMBL30002337 0.73 NAAA (0.52) SMN1; SMN2CA2HDAC1KMT2AHDAC3

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-8120893-B2 Tether-containing conducting polymers THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2012-02-21 US disclosed
US-20100073847-A1 TETHER-CONTAINING CONDUCTING POLYMERS THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2010-03-25 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-20100073847-A1 TETHER-CONTAINING CONDUCTING POLYMERS SPIN4, PAH, SMC4 SMN1; SMN2 2798/4885CA2 688/4885CA1 1079/4885

“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.