SCHEMBL4807338

SCHEMBL4807338

CS(=O)(=O)N1CCc2cc[c]cc21

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.43
GLA P06280 1/20 0.43
HPGD P15428 1/20 0.42
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
PKM P14618 1/20 0.40
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
GAA P10253 1/20 0.39
GFER P55789 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HTT P42858 2/20 0.38
LMNA P02545 1/20 0.38
NPC1 O15118 5/20 0.38
RAB9A P51151 4/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NLRP3 Q96P20 2/20 0.36
TSHR P16473 1/20 0.36
MMP13 P45452 1/20 0.36

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
SCHEMBL551572 0.87 POLB (0.47) POLBGLAHPGDCYP11B1CYP11B2
SCHEMBL4804140 0.84 MAPT (0.43) POLBCYP11B1CYP11B2MEN1KMT2A
SCHEMBL4808374 0.78 CYP3A4 (0.54) PKMMEN1KMT2AGAAHTT
SCHEMBL698427 0.78 TP53 (0.44) HPGDMEN1KMT2ASMN1; SMN2NLRP3
SCHEMBL2102471 0.75 KMT2A (0.58) POLBGLACYP11B1CYP11B2PKM
SCHEMBL4813838 0.75 TSHR (0.70) POLBGLAHPGDMEN1KMT2A
SCHEMBL4859348 0.73 MEN1 (0.31) MEN1KMT2A
SCHEMBL1450385 0.73 ALDH1A1 (0.34) HPGDMEN1KMT2AGAALMNA
SCHEMBL4808920 0.72 TSHR (0.49) PKMMEN1KMT2AGAAL3MBTL1
SCHEMBL4715942 0.72 ESR1 (0.51) MEN1KMT2AL3MBTL1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7381734-B2 Serine protease inhibitors TULARIK LIMITED (GB) 2008-06-03 US disclosed
EP-1240154-B1 SERINE PROTEASE INHIBITORS TULARIK LTD (GB) 2007-02-28 EP disclosed
US-7157585-B2 Serine protease inhibitors TULARIK LIMITED (GB) 2007-01-02 US disclosed
EP-1294691-B1 SERINE PROTEASE INHIBITORS TULARIK LTD (GB) 2006-11-08 EP disclosed
US-7074934-B2 An aromatic alkylamino compound containing a lipophilic group useful as antithrombotic agent as well as treats asthma TULARIK LIMITED (GB) 2006-07-11 US disclosed
US-7067516-B2 Serine protease inhibitors TULARIK LIMITED (GB) 2006-06-27 US disclosed
US-20050267173-A1 Serine protease inhibitors LIVELY SARAH E 2005-12-01 US disclosed
US-20050215587-A1 Serine protease inhibitors LIVELY SARAH E 2005-09-29 US disclosed
US-6916957-B2 Serine protease inhibitors TULARIK LIMITED (GB) 2005-07-12 US disclosed
US-20040116439-A1 Serine protease inhibitors TULARIK LIMITED (GB) 2004-06-17 US disclosed
US-20030216403-A1 Serine protease inhibitors TULARIK LIMITED (GB) 2003-11-20 US disclosed
US-20030018059-A1 Serine protease inhibitors PROTHERICS MOLECULAR DESIGN LIMITED (GB) 2003-01-23 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-20050215587-A1 Serine protease inhibitors PRSS1, TPSAB1, CMA1 POLB 4675/4885GLA 249/4885HPGD 807/4885
US-20030216403-A1 Serine protease inhibitors SERPINB1, SERPINE1, PRSS1 POLB 4499/4885GLA 268/4885HPGD 313/4885
US-20030018059-A1 Serine protease inhibitors TPSAB1, PRSS1, SERPINB1 POLB 4755/4885GLA 296/4885HPGD 1054/4885
US-20050267173-A1 Serine protease inhibitors PRSS1, TPSAB1, CMA1 POLB 4675/4885GLA 249/4885HPGD 807/4885

“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.