SCHEMBL22199629

SCHEMBL22199629

CCCCNC(=O)C(Cc1ccccc1)NC(=O)C(CCCCN)NC(C)CCC

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TLR2 O60603 2/20 0.59
▸ CHRNB2 P17787 1/20 0.58
▸ CHRNB4 P30926 1/20 0.58
▸ CHRNA3 P32297 1/20 0.58
▸ CHRNA4 P43681 1/20 0.58
▸ F2 P00734 2/20 0.53
▸ CHRND Q07001 7/20 0.53
▸ CHRNA1 P02708 3/20 0.53
▸ CHRNG P07510 3/20 0.53
▸ CHRNB1 P11230 3/20 0.53
▸ CALCRL Q16602 1/20 0.52
▸ GRIA1 P42261 3/20 0.50

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
SCHEMBL22045372 0.83 GNPAT (0.52) TLR2CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL25062089 0.82 MMP2 (0.53) —
SCHEMBL20669101 0.81 OPRK1 (0.61) TLR2CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL22388988 0.80 GNPAT (0.53) CALCRL
SCHEMBL25062471 0.79 TLR2 (0.57) TLR2CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL22030266 0.79 OPRK1 (0.63) —
SCHEMBL23901052 0.78 MMP2 (0.54) —
SCHEMBL23106089 0.78 F2 (0.47) TLR2CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL21788100 0.78 GNPAT (0.50) CALCRL
Lysine SCHEMBL9441740 0.77 CHRNB2 (0.65) TLR2CHRNB2CHRNB4CHRNA3CHRNA4

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-11129910-B2 Specific conjugation linkers, specific immunoconjugates thereof, methods of making and uses such conjugates thereof HANGZHOU DAC BIOTECH CO., LTD. (CN) 2021-09-28 — — US disclosed
US-20200215206-A1 SPECIFIC CONJUGATION LINKERS, SPECIFIC IMMUNOCONJUGATES THEREOF, METHODS OF MAKING AND USES SUCH CONJUGATES THEREOF SUZHOU M-CONJ BIOTECH CO., LTD. (CN) 2020-07-09 — — 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-11129910-B2 Specific conjugation linkers, specific immunoconjugates thereof, methods of making and uses such conjugates thereof SLC25A1, GCDH, FH TLR2 2113/4885CHRNB2 4071/4885CHRNB4 4248/4885
US-20200215206-A1 SPECIFIC CONJUGATION LINKERS, SPECIFIC IMMUNOCONJUGATES THEREOF, METHODS OF MAKING AND USES SUCH CONJUGATES THEREOF SLC25A1, GCDH, FH TLR2 2113/4885CHRNB2 4071/4885CHRNB4 4248/4885

“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.

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