SCHEMBL5208684

SCHEMBL5208684

CC(=O)c1cn(Cc2ccccc2)c2ccc(N)cc12

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.57
L3MBTL1 Q9Y468 2/20 0.53
MAPK1 P28482 1/20 0.52
LMNA P02545 3/20 0.51
CNR1 P21554 1/20 0.50
CNR2 P34972 1/20 0.50
ADORA1 P30542 1/20 0.50
PLA2G2A P14555 4/20 0.49
ALDH1A1 P00352 2/20 0.49
NPSR1 Q6W5P4 1/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
NOD2 Q9HC29 1/20 0.48
CREBBP Q92793 1/20 0.48
TP53 P04637 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL15712247 0.86 LMNA (0.60) L3MBTL1MAPK1LMNACNR2ADORA1
SCHEMBL30049353 0.83 POLB (0.79) POLBL3MBTL1MAPK1LMNACNR1
SCHEMBL17324721 0.83 POLB (0.79) POLBL3MBTL1MAPK1LMNACNR1
SCHEMBL5210375 0.80 POLB (0.53) POLBL3MBTL1MAPK1LMNACNR1
SCHEMBL21295511 0.79 PLA2G2A (0.48) LMNACNR1CNR2PLA2G2AALDH1A1
SCHEMBL14406116 0.78 SERPINE1 (0.57) L3MBTL1MAPK1LMNACNR1CNR2
SCHEMBL4811701 0.76 POLB (0.57) POLBL3MBTL1MAPK1LMNACNR1
SCHEMBL9056108 0.76 LMNA (0.55) POLBL3MBTL1MAPK1LMNACNR1
SCHEMBL20923879 0.76 KCNH2 (0.42) POLBL3MBTL1MAPK1LMNACNR1
SCHEMBL19208616 0.75 LMNA (0.54) POLBL3MBTL1LMNAALDH1A1NPSR1

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
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
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-20030018059-A1 Serine protease inhibitors PROTHERICS MOLECULAR DESIGN LIMITED (GB) 2003-01-23 US disclosed
WO-2000077027-A2 SERINE PROTEASE INHIBITORS TULARIK LIMITED (GB) 2000-12-21 WO 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-20050215587-A1 Serine protease inhibitors PRSS1, TPSAB1, CMA1 POLB 4675/4885L3MBTL1 625/4885MAPK1 2266/4885
US-20030018059-A1 Serine protease inhibitors TPSAB1, PRSS1, SERPINB1 POLB 4755/4885L3MBTL1 896/4885MAPK1 1807/4885

“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.