SCHEMBL18786349

SCHEMBL18786349

CCNC(=O)CCC(C)(C)C(C)C

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.44
CAPN1 P07384 2/20 0.40
MCL1 Q07820 1/20 0.36
ALDH1A1 P00352 2/20 0.35
KMT2A Q03164 1/20 0.33
PIK3CD O00329 1/20 0.33
HPGD P15428 2/20 0.33
TSHR P16473 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
GAA P10253 1/20 0.32
RECQL P46063 1/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MMP2 P08253 2/20 0.31
MMP9 P14780 2/20 0.31

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
SCHEMBL21611749 0.81 ALDH1A1 (0.41) FAAHALDH1A1KMT2AGAA
SCHEMBL25083829 0.79 PIK3CD (0.39) FAAHCAPN1MCL1KMT2APIK3CD
SCHEMBL18787676 0.79 LMNA (0.41) MCL1ALDH1A1PIK3CDLMNA
SCHEMBL9483993 0.79 FAAH (0.50) FAAHCAPN1MCL1ALDH1A1KMT2A
SCHEMBL22787266 0.78 MEN1 (0.47) FAAHALDH1A1KMT2APIK3CDHPGD
SCHEMBL22167637 0.77 FAAH (0.48) FAAHCAPN1MCL1ALDH1A1KMT2A
SCHEMBL21016053 0.75 FAAH (0.47) FAAHCAPN1MCL1ALDH1A1KMT2A
SCHEMBL17327636 0.75 FAAH (0.47) FAAHCAPN1MCL1ALDH1A1KMT2A
SCHEMBL18965092 0.75 FAAH (0.47) FAAHCAPN1MCL1ALDH1A1KMT2A
SCHEMBL19200702 0.74 FAAH (0.50) FAAHMCL1ALDH1A1KMT2AHPGD

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-3831841-A1 NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF S&T Global Inc. (US) 2021-06-09 EP disclosed
WO-2017200984-A1 NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF S&T GLOBAL INC. (US) 2017-11-23 WO disclosed
US-20170114341-A1 POLYNUCLEOTIDE CONSTRUCTS HAVING BIOREVERSIBLE AND NON-BIOREVERSIBLE GROUPS BRADSHAW CURT W (US) 2017-04-27 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-20170114341-A1 POLYNUCLEOTIDE CONSTRUCTS HAVING BIOREVERSIBLE AND NON-BIOREVERSIBLE GROUPS HNRNPC, RNASE1, NSUN3 FAAH 4672/4885CAPN1 2839/4885MCL1 318/4885

“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.