SCHEMBL5642478

SCHEMBL5642478

O=C(NCC1CC(=O)N(c2ccc(C3(CN4CCOCC4)CC3)cc2)C1)c1cc2cc(Cl)ccc2[nH]1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PYGL P06737 9/20 0.46
▸ CNR1 P21554 1/20 0.43
▸ FPR2 P25090 2/20 0.42
▸ FPR1 P21462 1/20 0.42
▸ DRD3 P35462 1/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ PLD2 O14939 1/20 0.40
▸ PLD1 Q13393 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.39
▸ ENPP2 Q13822 1/20 0.39
▸ EHMT2 Q96KQ7 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
SCHEMBL5638146 0.93 CNR1 (0.46) PYGLCNR1DRD3PLD2PLD1
SCHEMBL5639903 0.93 CNR1 (0.47) PYGLCNR1DRD3EHMT2
SCHEMBL5641659 0.88 FPR2 (0.41) PYGLFPR2FPR1KDM4EALDH1A1
SCHEMBL5640239 0.87 ALOX15 (0.41) PYGLCNR1FPR2FPR1KDM4E
SCHEMBL5638730 0.85 HRH4 (0.47) PYGLCNR1
SCHEMBL5643086 0.83 KDM4E (0.48) DRD3KDM4EALDH1A1PLD2PLD1
SCHEMBL5640430 0.81 F10 (0.36) CNR1FPR2FPR1KDM4EHSD17B10
SCHEMBL5640479 0.80 CNR1 (0.53) PYGLCNR1DRD3MAPT
SCHEMBL5639220 0.79 ALOX15 (0.44) PYGL
SCHEMBL5643133 0.79 BCHE (0.43) FPR2FPR1PLD2PLD1ENPP2

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 PYGL 1786/4885CNR1 2663/4885FPR2 3505/4885

“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.

Send feedback