SCHEMBL5643192

SCHEMBL5643192

O=C(NCC1CC(=O)N(c2ccc(-n3ccccc3=O)cc2)C1)c1nc2ccccc2s1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 3/20 0.54
▸ MAPT P10636 2/20 0.45
▸ LMNA P02545 2/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ L3MBTL1 Q9Y468 3/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ TP53 P04637 1/20 0.43
▸ CNR2 P34972 1/20 0.41
▸ MAOB P27338 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ HPGD P15428 1/20 0.40
▸ NPC1 O15118 2/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ PKM P14618 1/20 0.39
▸ NFKB1 P19838 1/20 0.39
▸ NFKB2 Q00653 1/20 0.39
▸ RELA Q04206 1/20 0.39

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
SCHEMBL5640096 0.90 MAPT (0.43) CNR1MAPTLMNAMEN1KMT2A
SCHEMBL5640928 0.90 MAPT (0.43) CNR1MAPTLMNAMEN1KMT2A
SCHEMBL5641661 0.84 CNR1 (0.47) CNR1MAPTLMNAMEN1KMT2A
SCHEMBL4587434 0.80 CTSL (0.46) PKM
SCHEMBL4593896 0.80 USP30 (0.52) MAPTLMNACNR2SMN1; SMN2ALDH1A1
SCHEMBL5640377 0.79 CNR1 (0.49) CNR1MAPTLMNAMEN1KMT2A
SCHEMBL5639845 0.79 ACKR3 (0.49) —
SCHEMBL5637629 0.79 F10 (0.54) —
SCHEMBL5640924 0.79 F10 (0.61) —
SCHEMBL5641296 0.78 TP53 (0.50) LMNAL3MBTL1TP53MAOBHPGD

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-7199149-B2 Monocyclic and bicyclic lactams as factor Xa inhibitors BRISTOL MYERS SQUIBB COMPANY (US) 2007-04-03 — — US disclosed
US-20050107361-A1 Monocyclic and bicyclic lactams as factor Xa inhibitors BRISTOL-MYERS SQUIBB COMANY 2005-05-19 — — 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-20050107361-A1 Monocyclic and bicyclic lactams as factor Xa inhibitors F2, F12, SPINT2 CNR1 2663/4885MAPT 4614/4885LMNA 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.

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