SCHEMBL13550996

SCHEMBL13550996

CN(C)c1ccc(-c2cnc(-c3ccc(S(=O)(=O)NCCCC45CC6CC(C4)C65)cc3)o2)cc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.42
TP53 P04637 8/20 0.36
LMNA P02545 7/20 0.36
MAPT P10636 6/20 0.36
NPC1 O15118 2/20 0.36
POLB P06746 3/20 0.35
MMP2 P08253 3/20 0.35
MMP9 P14780 3/20 0.35
TDP1 Q9NUW8 1/20 0.35
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL6014544 0.81 HTR6 (0.47) HTR6TP53LMNAMAPTNPC1
SCHEMBL6014405 0.78 HTR6 (0.48) HTR6TP53LMNAMAPTNPC1
SCHEMBL6014471 0.77 HTR6 (0.48) HTR6POLBKMT2A
SCHEMBL6014370 0.75 HTR6 (0.50) HTR6TP53LMNAMAPTKMT2A
SCHEMBL6014472 0.74 MMP2 (0.47) HTR6TP53LMNAMAPTNPC1
SCHEMBL6014355 0.74 MMP9 (0.48) HTR6TP53LMNAMAPTNPC1
SCHEMBL6014512 0.73 HTR6 (0.44) HTR6TP53LMNAMAPTNPC1
SCHEMBL300386 0.73 HTR6 (0.44) HTR6TP53LMNAMAPTNPC1
SCHEMBL6014500 0.71 MMP2 (0.43) HTR6TP53LMNAMAPTNPC1
SCHEMBL6014557 0.71 HTR6 (0.42) HTR6TP53LMNAMAPTNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100019169-A1 REMOTE LASER INTERROGATION OF THREAT CLOUDS AND SURFACES MICHIGAN MOLECULAR INSTITUTE (US) 2010-01-28 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-20100019169-A1 REMOTE LASER INTERROGATION OF THREAT CLOUDS AND SURFACES SELL, LGALS2, LGALS4 HTR6 3589/4885TP53 207/4885LMNA 133/4885

“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.