SCHEMBL4906987

SCHEMBL4906987

CCOC(=O)Cc1csc(-c2ccc(C(C)(C)C)cc2)n1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.53
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
TP53 P04637 1/20 0.51
MAPT P10636 4/20 0.51
ALDH1A1 P00352 3/20 0.50
KDM4E B2RXH2 1/20 0.50
HPGD P15428 1/20 0.50
POLB P06746 2/20 0.49
LMNA P02545 3/20 0.47
KCNH2 Q12809 1/20 0.47
GAA P10253 1/20 0.47

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
SCHEMBL4905943 0.89 POLB (0.62) SMN1; SMN2MEN1KMT2ATP53MAPT
SCHEMBL3374076 0.87 MEN1 (0.57) SMN1; SMN2MEN1KMT2ATP53MAPT
SCHEMBL4907597 0.85 LMNA (0.67) SMN1; SMN2MEN1KMT2ATP53MAPT
SCHEMBL2073208 0.85 MAPT (0.65) SMN1; SMN2MEN1KMT2ATP53MAPT
SCHEMBL11157975 0.85 MEN1 (0.62) SMN1; SMN2MEN1KMT2AMAPTALDH1A1
SCHEMBL6311629 0.84 MAPT (0.66) SMN1; SMN2MEN1KMT2ATP53MAPT
SCHEMBL7971165 0.84 MEN1 (0.53) SMN1; SMN2MEN1KMT2AMAPTALDH1A1
SCHEMBL2075250 0.84 ALDH1A1 (0.72) MEN1KMT2ATP53MAPTALDH1A1
SCHEMBL6954872 0.81 MEN1 (0.53) SMN1; SMN2MEN1KMT2AMAPTALDH1A1
SCHEMBL31578670 0.80 ALDH1A1 (0.60) MEN1KMT2ATP53MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080090829-A1 SUBSTITUTED HETEROARYL- AND PHENYLSULFAMOYL COMPOUNDS PFIZER INC. 2008-04-17 US disclosed
EP-1765796-A1 SUBSTITUTED HETEROARYL- AND PHENYLSULFAMOYL COMPOUNDS Pfizer Products Inc. (US) 2007-03-28 EP disclosed
US-20060229363-A1 Substituted Heteroaryl- and Phenylsulfamoyl Compounds HAMANAKA ERNEST S 2006-10-12 US disclosed
WO-2006003495-A1 SUBSTITUTED HETEROARYL- AND PHENYLSULFAMOYL COMPOUNDS PFIZER PRODUCTS INC. (US) 2006-01-12 WO disclosed
US-20050288340-A1 Substituted heteroaryl- and phenylsulfamoyl compounds PFIZER INC 2005-12-29 US disclosed
US-20030171588-A1 1,2-disubstituted-6-oxo-3-phenyl-piperidine-3-carboxamides and combinatorial libraries thereof LION BIOSCIENCE AG (DE) 2003-09-11 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 (4 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-20060229363-A1 Substituted Heteroaryl- and Phenylsulfamoyl Compounds PPARA, PPARG, PPARD SMN1; SMN2 3271/4885MEN1 4859/4885KMT2A 3602/4885
US-20050288340-A1 Substituted heteroaryl- and phenylsulfamoyl compounds PPARA, PPARG, PPARD SMN1; SMN2 3404/4885MEN1 4855/4885KMT2A 3530/4885
US-20030171588-A1 1,2-disubstituted-6-oxo-3-phenyl-piperidine-3-carboxamides and combinatorial libraries thereof BRD4, BICRA, HDAC6 SMN1; SMN2 1499/4885MEN1 4019/4885KMT2A 202/4885
US-20080090829-A1 SUBSTITUTED HETEROARYL- AND PHENYLSULFAMOYL COMPOUNDS PPARA, PPARG, PPARD SMN1; SMN2 3404/4885MEN1 4855/4885KMT2A 3530/4885

“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.