SCHEMBL12995257

SCHEMBL12995257

CCOc1ccc2c(S(=O)(=O)NC3CC3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.41
LMNA P02545 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 5/20 0.35
MEN1 O00255 3/20 0.35
ALDH1A1 P00352 2/20 0.35
GAA P10253 1/20 0.35
POLB P06746 1/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 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
SCHEMBL12995083 0.95 TP53 (0.42) TP53LMNASMN1; SMN2MAPTKMT2A
SCHEMBL12995256 0.91 KMT2A (0.36) TP53LMNASMN1; SMN2MAPTKMT2A
SCHEMBL12995258 0.88 HRH3 (0.34) TP53LMNAMAPT
SCHEMBL12995382 0.87 NPC1 (0.50) TP53LMNASMN1; SMN2MAPTKMT2A
SCHEMBL10096102 0.86 KMT2A (0.38) TP53LMNASMN1; SMN2MAPTKMT2A
SCHEMBL12995089 0.86 MMP2 (0.40) TP53LMNASMN1; SMN2MAPTKMT2A
SCHEMBL12995219 0.86 KMT2A (0.39) TP53LMNASMN1; SMN2MAPTKMT2A
SCHEMBL12995267 0.86 MEN1 (0.39) TP53LMNASMN1; SMN2MAPTKMT2A
SCHEMBL14467126 0.85 MEN1 (0.39) TP53LMNASMN1; SMN2MAPTKMT2A
SCHEMBL10097435 0.85 MEN1 (0.38) TP53SMN1; SMN2MAPTKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100305100-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2010-12-02 US disclosed
US-20100305100-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2010-12-02 US disclosed
US-7772271-B2 Methods for treating hepatitis C PTC THERAPEUTICS, INC. (US) 2010-08-10 US disclosed
US-7772271-B2 Methods for treating hepatitis C PTC THERAPEUTICS, INC. (US) 2010-08-10 US disclosed
US-20070299068-A1 Methods for treating hepatitis C PTC THERAPEUTICS, INC. 2007-12-27 US disclosed
US-20070299068-A1 Methods for treating hepatitis C PTC THERAPEUTICS, INC. 2007-12-27 US disclosed
WO-2007084413-A2 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2007-07-26 WO 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 (2 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-20070299068-A1 Methods for treating hepatitis C HAVCR2, EIF2AK2, MAVS TP53 1262/4885LMNA 1012/4885SMN1; SMN2 3609/4885
US-20100305100-A1 METHODS FOR TREATING HEPATITIS C HAVCR2, EIF2AK2, MAVS TP53 1262/4885LMNA 1012/4885SMN1; SMN2 3609/4885

“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.