SCHEMBL6765079

SCHEMBL6765079

COC(=O)C1C(=O)CC2CCC1C2

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 9/20 0.42
CYP1A2 P05177 2/20 0.39
HIF1A Q16665 1/20 0.39
ALDH1A1 P00352 2/20 0.38
SLC6A4 P31645 6/20 0.38
BRD4 O60885 1/20 0.34
POLB P06746 1/20 0.34
MEN1 O00255 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
KMT2A Q03164 1/20 0.33
EPHX2 P34913 1/20 0.33
CHRNB2 P17787 1/20 0.33
CHRNB4 P30926 1/20 0.33
CHRNA3 P32297 1/20 0.33
CHRNA7 P36544 1/20 0.33
CHRNA4 P43681 1/20 0.33

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
SCHEMBL19807408 1.00 SLC6A3 (0.42) SLC6A3CYP1A2HIF1AALDH1A1SLC6A4
SCHEMBL19229897 0.82 EPHX2 (0.43) CYP1A2ALDH1A1POLBMEN1CYP2C9
SCHEMBL854658 0.73 TLR4 (0.39) CYP1A2ALDH1A1POLBMEN1CYP2C9
SCHEMBL11384348 0.72 SLC6A3 (0.36) SLC6A3ALDH1A1SLC6A4BRD4
SCHEMBL7419212 0.71 CYP1A2 (0.45) SLC6A3CYP1A2HIF1AALDH1A1BRD4
SCHEMBL18527521 0.71 CYP1A2 (0.45) SLC6A3CYP1A2HIF1AALDH1A1BRD4
SCHEMBL9730177 0.71 ALDH1A1 (0.46) CYP1A2HIF1AALDH1A1BRD4KMT2A
SCHEMBL706994 0.69 CHRNB2 (0.39) SLC6A3CYP1A2HIF1AALDH1A1BRD4
SCHEMBL5897591 0.69 CYP1A2 (0.39) CYP1A2HIF1AALDH1A1BRD4POLB
SCHEMBL1874741 0.69 CYP1A2 (0.39) CYP1A2HIF1AALDH1A1BRD4POLB

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-1493744-B1 Tropane analogs and methods for inhibition of monoamine transport ORGANIX INC (US) 2009-11-25 EP disclosed
US-6677338-B2 FOR THERAPY OF DEPRESSION PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2004-01-13 US disclosed
US-20030105096-A1 Serotonin transport inhibitors WILMINGTON TRUST (LONDON) LIMITED, AS SECURITY AGENT (GB) 2003-06-05 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-20030105096-A1 Serotonin transport inhibitors SLC6A4, SLC6A2, SLC18A2 SLC6A3 4/4885CYP1A2 600/4885HIF1A 3372/4885

“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.