SCHEMBL4152699

SCHEMBL4152699

COC(=O)c1sc(-c2ccc(-c3cn4ccsc4n3)cc2)cc1N(C(=O)C1CCC(C)CC1)C(C)C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 14/20 0.46
NPC1 O15118 7/20 0.46
RAB9A P51151 7/20 0.46
SMN1; SMN2 Q16637 7/20 0.46
HPGD P15428 2/20 0.43
PKM P14618 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
MAPT P10636 7/20 0.43
NFKB1 P19838 2/20 0.43
NFKB2 Q00653 2/20 0.43
RELA Q04206 2/20 0.43
HTT P42858 1/20 0.41
POLB P06746 3/20 0.40
LMNA P02545 2/20 0.39
THRB P10828 1/20 0.39
TSHR P16473 2/20 0.39
MAPK1 P28482 2/20 0.39
RXFP1 Q9HBX9 1/20 0.39
GAA P10253 1/20 0.39
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL13852134 1.00 TP53 (0.46) TP53NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL4144146 0.93 TP53 (0.40) TP53NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL4144142 0.93 TP53 (0.40) TP53NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL4143238 0.91 TP53 (0.46) TP53NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL4143244 0.91 TP53 (0.46) TP53NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL4140640 0.91 TP53 (0.43) TP53NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL4140637 0.91 TP53 (0.43) TP53NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL4155723 0.87 KDM4E (0.43) TP53NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL4155724 0.87 KDM4E (0.43) TP53NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL4151930 0.85 NPC1 (0.40) NPC1RAB9ASMN1; SMN2HPGDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090136448-A1 Antiviral 2-Carboxy-Thiophene Compounds CORFIELD JOHN ANDREW 2009-05-28 US disclosed
US-20090136448-A1 Antiviral 2-Carboxy-Thiophene Compounds CORFIELD JOHN ANDREW 2009-05-28 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 (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-20090136448-A1 Antiviral 2-Carboxy-Thiophene Compounds EIF2AK2, HAVCR2, MAVS TP53 1525/4885NPC1 1833/4885RAB9A 1920/4885

“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.