SCHEMBL4515652

SCHEMBL4515652

COC(=O)c1cc(Cl)c(Cl)cc1-c1nc2ccsc2c(=O)[nH]1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 3/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ PDE5A O76074 1/20 0.47
▸ SPR P35270 3/20 0.46
▸ RXFP1 Q9HBX9 1/20 0.44
▸ MAPT P10636 2/20 0.43
▸ RHEB Q15382 1/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ CASP3 P42574 1/20 0.40
▸ SENP8 Q96LD8 1/20 0.40
▸ SENP7 Q9BQF6 1/20 0.40
▸ SENP6 Q9GZR1 1/20 0.40
▸ CTDSP1 Q9GZU7 2/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ GLA P06280 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ SLC2A1 P11166 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
SCHEMBL4518930 0.86 SPR (0.55) RAB9ASMN1; SMN2PDE5ASPRMAPT
SCHEMBL22287932 0.74 RAB9A (0.54) RAB9ASMN1; SMN2PDE5ASPRRXFP1
SCHEMBL28051087 0.73 GUSB (0.61) RAB9ASMN1; SMN2PDE5ASPRMAPT
SCHEMBL13789347 0.72 SMN1; SMN2 (0.51) RAB9ASMN1; SMN2PDE5ASPRMAPT
SCHEMBL4503183 0.72 KMT2A (0.34) RAB9ASMN1; SMN2RXFP1MAPTRHEB
SCHEMBL30577613 0.72 NQO2 (0.46) RAB9ASMN1; SMN2RXFP1MAPTL3MBTL1
SCHEMBL29398836 0.70 KDM4E (0.57) RAB9ASMN1; SMN2PDE5ASPRRXFP1
SCHEMBL5482863 0.70 PDE5A (0.72) RAB9ASMN1; SMN2PDE5ASPRRXFP1
SCHEMBL13789326 0.69 SMN1; SMN2 (0.50) RAB9ASMN1; SMN2PDE5ASPRMAPT
SCHEMBL13789304 0.69 SMN1; SMN2 (0.56) RAB9ASMN1; SMN2PDE5ASPRRXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7557112-B2 Aromatic-ring-fused pyrimidine derivative ASTELLAS PHARMA INC. (JP) 2009-07-07 — — US disclosed
US-20070249587-A1 Aromatic-Ring-Fused Pyrimidine Derivative ASTELLAS PHARMA INC. (JP) 2007-10-25 — — US disclosed
EP-1806347-A1 AROMATIC-RING-FUSED PYRIMIDINE DERIVATIVE Astellas Pharma Inc. (JP) 2007-07-11 — — EP 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-20070249587-A1 Aromatic-Ring-Fused Pyrimidine Derivative GPR119, NOD1, IRS1 RAB9A 3054/4885SMN1; SMN2 2701/4885PDE5A 2503/4885

“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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