SCHEMBL6640189

SCHEMBL6640189

COC(=O)C1=CCCN(Cc2ccccc2)C1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.54
CHRM2 P08172 1/20 0.54
CHRM4 P08173 1/20 0.54
CHRM5 P08912 1/20 0.54
THRB P10828 1/20 0.54
CHRM1 P11229 1/20 0.54
CHRM3 P20309 1/20 0.54
BLM P54132 1/20 0.52
MCOLN3 Q8TDD5 1/20 0.52
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
ALDH1A1 P00352 4/20 0.46
MAPT P10636 1/20 0.46
OPRK1 P41145 1/20 0.46
HSD17B10 Q99714 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
KDM4E B2RXH2 1/20 0.45

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
Hydrochloric Acid SCHEMBL11136899 0.86 LMNA (0.51) LMNACHRM2CHRM4CHRM5THRB
Hydrochloric Acid SCHEMBL11139509 0.86 LMNA (0.51) LMNACHRM2CHRM4CHRM5THRB
SCHEMBL7534318 0.86 MEN1 (0.47) LMNAMEN1KMT2AALDH1A1MAPT
Hydrochloric Acid SCHEMBL11138346 0.85 LMNA (0.50) LMNACHRM2CHRM4CHRM5THRB
SCHEMBL10914396 0.84 CYP2D6 (0.47) LMNABLMKMT2AALDH1A1SMN1; SMN2
SCHEMBL11136071 0.84 SLC6A1 (0.57) LMNABLMKMT2AALDH1A1KDM4E
Hydrochloric Acid SCHEMBL11139059 0.83 LMNA (0.49) LMNACHRM2CHRM4CHRM5THRB
Hydrochloric Acid SCHEMBL11138951 0.82 OPRK1 (0.61) LMNACHRM2CHRM4CHRM5THRB
SCHEMBL11134238 0.79 LMNA (0.46) LMNACHRM2CHRM4CHRM5THRB
SCHEMBL9594492 0.78 SIGMAR1 (0.41) LMNABLMKMT2AALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6774132-B1 Spirooxindole derivatives that act as analgesics ASTRAZENECA AB (SE) 2004-08-10 US disclosed
EP-1426375-A2 Analgesic spiroindole derivatives AstraZeneca AB (SE) 2004-06-09 EP disclosed
US-20040087800-A1 Spirooxindole derivatives are analgesics for the treatment of chronic pain. ASTRAZENECA AB 2004-05-06 US disclosed
EP-1202994-B1 NEW COMPOUNDS ASTRAZENECA AB (SE) 2004-04-14 EP disclosed
CN-1361779-A Novel compounds ASTRAZENECA AB (SE) 2002-07-31 CN disclosed
EP-1202994-A1 NEW COMPOUNDS AstraZeneca AB (SE) 2002-05-08 EP disclosed
WO-2001005790-A1 NEW COMPOUNDS ASTRAZENECA AB (SE) 2001-01-25 WO disclosed
EP-0011447-B1 BLOOD PLATELET AGGREGATION INHIBITORY 1-BENZYL-1,2,5,6-TETRAHYDROPYRIDINE-3-CARBOXYLIC ACID DERIVATIVES AND SALTS THEREOF; PHARMACEUTICAL COMPOSITIONS THEREOF; AND ANALOGY PROCESSES FOR THE MANUFACTURE THEREOF IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1983-01-05 EP disclosed
US-4238488-A ANTICOAGULANTS IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1980-12-09 US disclosed
EP-0011447-A1 Blood platelet aggregation inhibitory 1-benzyl-1,2,5,6-tetrahydropyridine-3-carboxylic acid derivatives and salts thereof; pharmaceutical compositions thereof; and analogy processes for the manufacture thereof IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1980-05-28 EP 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-20040087800-A1 Spirooxindole derivatives are analgesics for the treatment of chronic pain. OPRK1, OPRD1, OPRL1 LMNA 3687/4885CHRM2 1021/4885CHRM4 1267/4885

“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.