SCHEMBL2706341

SCHEMBL2706341

O=S(=O)(Nc1ccccn1)c1ccc(Nc2nc(-c3cccnc3)cs2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 12/20 0.69
RAB9A P51151 12/20 0.69
SMN1; SMN2 Q16637 6/20 0.69
TP53 P04637 3/20 0.69
TDP1 Q9NUW8 2/20 0.69
MEN1 O00255 13/20 0.67
KMT2A Q03164 13/20 0.67
NCOA3 Q9Y6Q9 1/20 0.67
MAPT P10636 9/20 0.59
GAA P10253 3/20 0.59
LMNA P02545 2/20 0.59
PKM P14618 2/20 0.59
VCP P55072 1/20 0.59
MAPK1 P28482 3/20 0.58
KDM4E B2RXH2 1/20 0.56
GPR55 Q9Y2T6 1/20 0.56
PPP1CA P62136 1/20 0.56
CASP3 P42574 2/20 0.53
SENP8 Q96LD8 2/20 0.53
SENP7 Q9BQF6 2/20 0.53

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
SCHEMBL18029498 0.82 RAB9A (1.00) NPC1RAB9ASMN1; SMN2TP53TDP1
SCHEMBL2703762 0.80 MEN1 (1.00) NPC1RAB9ASMN1; SMN2TP53TDP1
SCHEMBL2705358 0.80 MEN1 (0.61) NPC1RAB9ASMN1; SMN2TP53TDP1
SCHEMBL2762873 0.79 KDM1A (0.72) NPC1RAB9ASMN1; SMN2TP53TDP1
SCHEMBL12639823 0.78 MAPK1 (0.86) NPC1RAB9ASMN1; SMN2TP53TDP1
SCHEMBL22680214 0.77 SMN1; SMN2 (0.71) NPC1RAB9ASMN1; SMN2TDP1MEN1
SCHEMBL712318 0.77 MEN1 (0.63) NPC1RAB9ATDP1MEN1KMT2A
SCHEMBL206486 0.75 MEN1 (0.76) NPC1RAB9ASMN1; SMN2TP53TDP1
SCHEMBL18083891 0.75 MEN1 (1.00) NPC1RAB9ASMN1; SMN2TP53TDP1
SCHEMBL12297431 0.75 MEN1 (0.76) NPC1RAB9ASMN1; SMN2TP53TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120108576-A1 THIAZOLE COMPOUNDS AND METHODS OF USE ACHILLION PHARMACEUTICALS, INC. (US) 2012-05-03 US disclosed
US-8088806-B2 Thiazole compounds and methods of use ACHILLION PHARMACEUTICALS, INC. (US) 2012-01-03 US disclosed
US-8088806-B2 Thiazole compounds and methods of use ACHILLION PHARMACEUTICALS, INC. (US) 2012-01-03 US disclosed
US-20070004711-A1 Thiazole compounds and methods of use ACHILLION PHARMACEUTICALS, INC. 2007-01-04 US disclosed
US-20070004711-A1 Thiazole compounds and methods of use ACHILLION PHARMACEUTICALS, INC. 2007-01-04 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 (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-20120108576-A1 THIAZOLE COMPOUNDS AND METHODS OF USE PIGS, CPT1A, SLC10A1 NPC1 62/4885RAB9A 1357/4885SMN1; SMN2 3252/4885
US-20070004711-A1 Thiazole compounds and methods of use PIGS, CPT1A, SLC10A1 NPC1 62/4885RAB9A 1357/4885SMN1; SMN2 3252/4885

“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.