SCHEMBL3516865

SCHEMBL3516865

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nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PDE4A P27815 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
USP2 O75604 1/20 0.36
SLCO1B1 Q9Y6L6 1/20 0.36
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.32
HSD17B10 Q99714 1/20 0.31
PIN1 Q13526 1/20 0.31
ALOX15 P16050 1/20 0.30
MGAM O43451 1/20 0.30
GAA P10253 1/20 0.30
SI P14410 1/20 0.30
MGAM2 Q2M2H8 1/20 0.30
SOAT1 P35610 1/20 0.30

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
SCHEMBL595004 0.93 LMNA (0.46) LMNAL3MBTL1PDE4ATDP1USP2
SCHEMBL11585200 0.91 LMNA (0.44) LMNAL3MBTL1PDE4ATDP1USP2
SCHEMBL8679740 0.89 LMNA (0.40) LMNAL3MBTL1PDE4ATDP1USP2
Demannose SCHEMBL3935915 0.81 LMNA (0.35) LMNAL3MBTL1PDE4ATDP1USP2
SCHEMBL6658970 0.81 ALDH1A1 (0.35) LMNAL3MBTL1PDE4ATDP1KDM4E
Propylene Glycol SCHEMBL7930115 0.78 TDP1 (0.48) LMNATDP1ALDH1A1HSD17B10PIN1
Alcohol SCHEMBL2046416 0.78 ALDH1A1 (0.46) LMNAALDH1A1HSD17B10PIN1ALOX15
SCHEMBL471892 0.78 ALDH1A1 (0.50) LMNAALDH1A1HSD17B10PIN1ALOX15
SCHEMBL22598 0.78
SCHEMBL344175 0.78

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-8354453-B2 Bupropion hydrobromide and therapeutic applications VALEANT INTERNATIONAL BERMUDA (BM) 2013-01-15 US disclosed
US-20100104639-A1 BUPROPION HYDROBROMIDE AND THERAPEUTIC APPLICATIONS BIOVAIL LABORATORIES INTERNATIONAL S.R.L. (BB) 2010-04-29 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-20100104639-A1 BUPROPION HYDROBROMIDE AND THERAPEUTIC APPLICATIONS GABBR1, SLC6A2, GABBR2 LMNA 3064/4885L3MBTL1 2077/4885PDE4A 1312/4885

“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.