SCHEMBL4679801

SCHEMBL4679801

COc1ccccc1C(=O)c1ccc(Br)cc1C(=O)N(C)CCO

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 1/20 0.43
CCND1 P24385 1/20 0.43
MAPT P10636 4/20 0.43
RAB9A P51151 3/20 0.43
NPC1 O15118 2/20 0.43
POLB P06746 3/20 0.41
LMNA P02545 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ALOX15 P16050 1/20 0.40
HSD17B10 Q99714 1/20 0.40
HPGD P15428 3/20 0.40
GAA P10253 2/20 0.40
KDM4E B2RXH2 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
RECQL P46063 1/20 0.40
KCNA3 P22001 1/20 0.39
AR P10275 1/20 0.39
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL4679118 0.95 CDK4 (0.43) CDK4CCND1MAPTRAB9ANPC1
SCHEMBL5222966 0.90 KDM4E (0.39) CDK4CCND1MAPTRAB9ANPC1
SCHEMBL21177597 0.85 POLB (0.48) MAPTPOLBLMNANPSR1HSD17B10
SCHEMBL4707506 0.82 MAPT (0.51) CDK4CCND1MAPTPOLBLMNA
SCHEMBL4682844 0.80 MAPT (0.50) MAPTRAB9ANPC1POLBLMNA
SCHEMBL4679798 0.80 CYP2C8 (0.46) CDK4CCND1POLBLMNAHPGD
SCHEMBL4676503 0.79 CDC25B (0.55) MAPTRAB9ANPC1POLBLMNA
SCHEMBL21179414 0.78 MAPT (0.46) MAPTPOLBLMNANPSR1HSD17B10
SCHEMBL4703665 0.77 MAPT (0.51) CDK4CCND1MAPTPOLBLMNA
SCHEMBL4675274 0.76 CDC25B (0.55) MAPTRAB9ANPC1POLBLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1572672-B1 BENZOXAZOCINES AND THEIR USE AS MONOAMINE-REUPTAKE INHIBITORS SOSEI R & D LTD (GB) 2008-08-13 EP disclosed
EP-1950206-A1 Benzoxazocines and their use as monoamine-reuptake inhibitors Sosei R&D Ltd. (GB) 2008-07-30 EP disclosed
US-20060019940-A1 Novel benzoxazocines and their therapeutic use SOSEI R&D LTD. (GB) 2006-01-26 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-20060019940-A1 Novel benzoxazocines and their therapeutic use HTR4, OPRM1, GRM4 CDK4 352/4885CCND1 546/4885MAPT 3319/4885

“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.