SCHEMBL22639458

SCHEMBL22639458

C1=C\CCC(N2CCCCC2)CCC/1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL3 Q96JM7 8/20 0.42
L3MBTL1 Q9Y468 7/20 0.42
KDM4E B2RXH2 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
MBTD1 Q05BQ5 5/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39
HTR6 P50406 1/20 0.38
SLC18A3 Q16572 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
TP53BP1 Q12888 1/20 0.36
L3MBTL4 Q8NA19 1/20 0.36

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 SCHEMBL27218548 0.98 L3MBTL3 (0.41) L3MBTL3L3MBTL1KDM4ETDP1MBTD1
Hydrochloric Acid SCHEMBL27218545 0.98 L3MBTL3 (0.41) L3MBTL3L3MBTL1KDM4ETDP1MBTD1
SCHEMBL19312856 0.93 L3MBTL3 (0.46) L3MBTL3L3MBTL1KDM4ETDP1MBTD1
SCHEMBL26630547 0.89 L3MBTL3 (0.41) L3MBTL3L3MBTL1KDM4ETDP1MBTD1
SCHEMBL22688665 0.86 L3MBTL3 (0.42) L3MBTL3L3MBTL1KDM4ETDP1MBTD1
SCHEMBL2227575 0.82 KDM4E (0.41) L3MBTL3L3MBTL1KDM4ETDP1MBTD1
SCHEMBL14838336 0.82 KDM4E (0.41) L3MBTL3L3MBTL1KDM4ETDP1MBTD1
SCHEMBL28902671 0.80 KDM4E (0.36) L3MBTL3L3MBTL1KDM4ETDP1MBTD1
SCHEMBL30909113 0.80 L3MBTL3 (0.36) L3MBTL3L3MBTL1KDM4ETDP1MBTD1
Ammonia Solution, Strong SCHEMBL7193166 0.80 HTR6 (0.52) L3MBTL3L3MBTL1MBTD1CYP2D6CYP2C19

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-20210015932-A1 BIOORTHOGONAL COMPOSITIONS TAMBO, INC. 2021-01-21 US disclosed
US-10828373-B2 Bioorthogonal compositions TAMBO, INC. (US) 2020-11-10 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 (2 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-10828373-B2 Bioorthogonal compositions CD47, EPHA2, MSN L3MBTL3 227/4885L3MBTL1 482/4885KDM4E 3801/4885
US-20210015932-A1 BIOORTHOGONAL COMPOSITIONS CD47, EPHA2, MSN L3MBTL3 227/4885L3MBTL1 482/4885KDM4E 3801/4885

“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.