SCHEMBL13638136

SCHEMBL13638136

CNC(=O)CCSSCCC(=O)NC1CCCCCC1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.60
▸ ALDH1A1 P00352 1/20 0.59
▸ SMN1; SMN2 Q16637 2/20 0.55
▸ HPGD P15428 6/20 0.53
▸ TSHR P16473 1/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.49
▸ HDAC3 O15379 2/20 0.47
▸ HDAC1 Q13547 2/20 0.47
▸ HDAC2 Q92769 2/20 0.47
▸ HDAC10 Q969S8 2/20 0.47
▸ HDAC11 Q96DB2 2/20 0.47
▸ HDAC8 Q9BY41 2/20 0.47
▸ HDAC6 Q9UBN7 2/20 0.47
▸ NCOR2 Q9Y618 1/20 0.47
▸ EPHX1 P07099 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ EPHX2 P34913 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ MAPT P10636 1/20 0.43

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
SCHEMBL9516460 0.91 ALDH1A1 (0.69) LMNAALDH1A1SMN1; SMN2HPGDTSHR
SCHEMBL19308752 0.87 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2HPGDTSHRNPSR1
SCHEMBL19308746 0.87 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2HPGDTSHRNPSR1
SCHEMBL10982270 0.81 SMN1; SMN2 (0.60) LMNAALDH1A1SMN1; SMN2HPGDTSHR
SCHEMBL14873215 0.78 NPSR1 (0.58) LMNAALDH1A1SMN1; SMN2HPGDNPSR1
SCHEMBL13638135 0.78 SMN1; SMN2 (0.56) LMNAALDH1A1SMN1; SMN2HPGDTSHR
SCHEMBL10587847 0.78 ALDH1A1 (0.83) LMNAALDH1A1SMN1; SMN2HPGDNPSR1
SCHEMBL6562134 0.78 LMNA (1.00) LMNAALDH1A1TSHRHDAC2KMT2A
SCHEMBL4894134 0.75 SMN1; SMN2 (0.57) LMNAALDH1A1SMN1; SMN2HPGDTSHR
SCHEMBL21261925 0.75 ALDH1A1 (0.49) LMNAALDH1A1SMN1; SMN2HPGDTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090281066-A1 Treatment of proliferative disorders with amino-substituted (E)-2,6- dialkoxystyryl 4-substituted benzylsulfones TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2009-11-12 — — 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-20090281066-A1 Treatment of proliferative disorders with amino-substituted (E)-2,6- dialkoxystyryl 4-substituted benzylsulfones CCNY, CCND2, ETV6 LMNA 1265/4885ALDH1A1 1156/4885SMN1; SMN2 3461/4885

“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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