SCHEMBL4586956

SCHEMBL4586956

O=C(NCC1CC(=O)N(c2ccc(N3CCCCC3=O)cc2)C1)c1ccc2cc(Cl)sc2c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.46
F10 P00742 8/20 0.45
LMNA P02545 2/20 0.45
F2 P00734 1/20 0.45
HSD17B10 Q99714 1/20 0.42
ALDH1A1 P00352 1/20 0.42
ATM Q13315 1/20 0.42
PRMT5 O14744 1/20 0.42
RECQL P46063 1/20 0.41
POLB P06746 1/20 0.41
CHRNA7 P36544 1/20 0.41
HTR3A P46098 1/20 0.41
HPGD P15428 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL4594192 0.86 MAPT (0.53) MAPTF10LMNAF2HSD17B10
SCHEMBL4586998 0.85 MAPT (0.52) MAPTF10LMNAHSD17B10ALDH1A1
SCHEMBL4586098 0.84 F10 (0.49) MAPTF10LMNAHPGD
SCHEMBL4586513 0.84 BCHE (0.50) MAPTF10LMNAHSD17B10ALDH1A1
SCHEMBL5644079 0.83 MAPT (0.65) MAPTF10LMNAF2HSD17B10
SCHEMBL5640665 0.83 F10 (0.49) MAPTF10LMNAF2ATM
SCHEMBL5639667 0.83 HSD17B10 (0.46) MAPTF10LMNAHSD17B10ALDH1A1
SCHEMBL4587128 0.83 MAPT (0.46) MAPTF10LMNAHSD17B10ALDH1A1
SCHEMBL5640350 0.82 MAPT (0.51) MAPTF10LMNAHSD17B10ALDH1A1
SCHEMBL4594373 0.82 MAPT (0.45) MAPTF10LMNAHSD17B10ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1667647-A4 MONOCYCLIC AND BICYCLIC LACTAMS AS FACTOR XA INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2008-10-22 EP disclosed
US-7199149-B2 Monocyclic and bicyclic lactams as factor Xa inhibitors BRISTOL MYERS SQUIBB COMPANY (US) 2007-04-03 US disclosed
EP-1667647-A2 MONOCYCLIC AND BICYCLIC LACTAMS AS FACTOR XA INHIBITORS Bristol-Myers Squibb Company (US) 2006-06-14 EP disclosed
US-20050107361-A1 Monocyclic and bicyclic lactams as factor Xa inhibitors BRISTOL-MYERS SQUIBB COMANY 2005-05-19 US disclosed
WO-2005032468-A2 MONOCYCLIC AND BICYCLIC LACTAMS AS FACTOR XA INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2005-04-14 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 (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-20050107361-A1 Monocyclic and bicyclic lactams as factor Xa inhibitors F2, F12, SPINT2 MAPT 4614/4885F10 18/4885LMNA 774/4885

“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.