SCHEMBL6735349

SCHEMBL6735349

O=Cc1c(Cc2ccccc2)sc2ccccc12

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 11/20 0.44
CYP2D6 P10635 1/20 0.40
CHRM1 P11229 1/20 0.40
HTR2A P28223 1/20 0.40
HRH1 P35367 1/20 0.40
LOXL2 Q9Y4K0 1/20 0.40
GPR3 P46089 1/20 0.39
NPC1 O15118 2/20 0.39
MAPT P10636 2/20 0.39
RAB9A P51151 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL23303025 0.81 CNR2 (0.46) PTPN1CYP2D6CHRM1HTR2AHRH1
SCHEMBL16672183 0.78 CALM1 (0.42) NPC1MAPTRAB9ASMN1; SMN2L3MBTL1
SCHEMBL6957346 0.76 PTPN1 (0.41) PTPN1LOXL2GPR3MAPTNPSR1
SCHEMBL6735723 0.73 HSP90AA1 (0.53) PTPN1MAPTSMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL6735720 0.73 HSP90AA1 (0.53) PTPN1MAPTSMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL6735726 0.73 HSP90AA1 (0.53) PTPN1MAPTSMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL19225704 0.72 GPR3 (0.46) LOXL2GPR3MAPTRAB9ASMN1; SMN2
SCHEMBL843065 0.72 GPR3 (0.46) GPR3NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL5792570 0.71 L3MBTL1 (0.49) GPR3NPC1L3MBTL1ALDH1A1LMNA
SCHEMBL11731930 0.71 PTPN1 (0.46) PTPN1NPC1MAPTRAB9ASMN1; SMN2

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-6683107-B2 THERAPY OF METABOLISM DISORDERS WYETH 2004-01-27 US disclosed
US-20030073709-A1 Furans, benzofurans, and thiophenes useful in the treatment of insulin resistance and hyperglycemia WYETH 2003-04-17 US disclosed
US-6451845-B1 ANTIDIABETIC AGENTS WYETH 2002-09-17 US disclosed
US-20020035272-A1 Furans, benzofurans, and thiophenes useful in the treatment of insulin resistance and hyperglycemia AMERICAN HOME PRODUCTS CORPORATION 2002-03-21 US disclosed
US-6248764-B1 ANTIDIABETIC AGENT; HYPOGLYCEMIC AGENT AMERICAN HOME PRODUCTS CORPORATION 2001-06-19 US disclosed
US-6103708-A USEFUL IN TREATING METABOLIC DISORDERS RELATED TO INSULIN RESISTANCE OR HYPERGLYCEMIA AMERICAN HOME PRODUCTS CORPORATION (US) 2000-08-15 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-20030073709-A1 Furans, benzofurans, and thiophenes useful in the treatment of insulin resistance and hyperglycemia GPR119, INSR, FFAR3 PTPN1 178/4885CYP2D6 315/4885CHRM1 2293/4885
US-20020035272-A1 Furans, benzofurans, and thiophenes useful in the treatment of insulin resistance and hyperglycemia INSR, GPR119, FFAR3 PTPN1 200/4885CYP2D6 270/4885CHRM1 2406/4885

“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.