SCHEMBL4594264

SCHEMBL4594264

O=C(NCC1CC(=O)N(c2ccc(N3CCCCC3=O)cc2)C1)c1cccc(Cl)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.67
F10 P00742 3/20 0.53
NPC1 O15118 3/20 0.52
RAB9A P51151 3/20 0.52
HPGD P15428 2/20 0.52
TSHR P16473 1/20 0.52
SMN1; SMN2 Q16637 3/20 0.50
ALDH1A1 P00352 3/20 0.50
USP2 O75604 2/20 0.50
MAPT P10636 1/20 0.50
KCNH2 Q12809 1/20 0.48
CACNA1I Q9P0X4 1/20 0.48
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
PRMT5 O14744 1/20 0.45
TP53 P04637 1/20 0.45
GLA P06280 1/20 0.45
PKM P14618 1/20 0.45
HSD17B10 Q99714 1/20 0.44

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 0.89 MAPT (0.53) LMNAF10NPC1RAB9AHPGD
SCHEMBL5644079 0.88 MAPT (0.65) LMNAF10NPC1RAB9AHPGD
SCHEMBL4587753 0.88 PRMT5 (0.54) LMNAF10NPC1RAB9AHPGD
SCHEMBL4586998 0.88 MAPT (0.52) LMNAF10NPC1RAB9AHPGD
SCHEMBL5640706 0.87 LMNA (0.50) LMNAF10NPC1RAB9AHPGD
SCHEMBL5640350 0.87 MAPT (0.51) LMNAF10NPC1RAB9AALDH1A1
SCHEMBL5640624 0.86 LMNA (0.49) LMNAF10NPC1RAB9AHPGD
SCHEMBL5639414 0.86 LMNA (0.49) LMNAF10NPC1RAB9AHPGD
SCHEMBL4586513 0.85 BCHE (0.50) LMNAF10ALDH1A1MAPTPRMT5
SCHEMBL5639753 0.83 MAPT (0.47) LMNAF10NPC1RAB9AHPGD

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 LMNA 774/4885F10 18/4885NPC1 2430/4885

“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.