SCHEMBL5491202

SCHEMBL5491202

CCCCCCCOc1ccc(-c2ccc(CCCO)cc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.67
KMT2A Q03164 2/20 0.67
CYP3A4 P08684 2/20 0.67
USP2 O75604 1/20 0.67
ALDH1A1 P00352 1/20 0.67
LMNA P02545 1/20 0.67
MAPK1 P28482 1/20 0.67
CASP1 P29466 1/20 0.67
SMN1; SMN2 Q16637 1/20 0.67
SLCO1B3 Q9NPD5 1/20 0.67
SLCO1B1 Q9Y6L6 1/20 0.67
RARB P10826 3/20 0.57
NR5A1 Q13285 1/20 0.56
TP53 P04637 2/20 0.53
NPC1 O15118 1/20 0.53
GAA P10253 1/20 0.53
RAB9A P51151 1/20 0.53
TSHR P16473 2/20 0.50
S1PR4 O95977 2/20 0.50
S1PR1 P21453 2/20 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
SCHEMBL877946 0.95 MEN1 (0.69) MEN1KMT2ACYP3A4USP2ALDH1A1
SCHEMBL23730898 0.95 MEN1 (0.72) MEN1KMT2ACYP3A4USP2ALDH1A1
SCHEMBL10706009 0.92 CYP3A4 (0.68) MEN1KMT2ACYP3A4USP2ALDH1A1
SCHEMBL28835278 0.90 MEN1 (0.75) MEN1KMT2ACYP3A4USP2ALDH1A1
SCHEMBL3948759 0.90 MEN1 (0.75) MEN1KMT2ACYP3A4USP2ALDH1A1
SCHEMBL23266202 0.90 MEN1 (0.75) MEN1KMT2ACYP3A4USP2ALDH1A1
SCHEMBL10705995 0.90 CYP3A4 (0.75) MEN1KMT2ACYP3A4USP2ALDH1A1
SCHEMBL6219270 0.90 MEN1 (0.75) MEN1KMT2ACYP3A4USP2ALDH1A1
SCHEMBL10980724 0.90 CYP3A4 (0.65) MEN1KMT2ACYP3A4USP2ALDH1A1
SCHEMBL8375389 0.90 CYP3A4 (0.65) MEN1KMT2ACYP3A4USP2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1100816-B1 AEROTHRICIN ANALOGS, THEIR PREPARATION AND USE BASILEA PHARMACEUTICA AG (CH) 2007-08-08 EP disclosed
EP-1251827-B1 NASALLY ADMINISTRABLE ANTIFUNGAL CYCLIC PEPTIDE COMPOSITIONS BASILEA PHARMACEUTICA AG (CH) 2004-05-26 EP disclosed
US-6489440-B1 Cyclic compounds BASILEA PHARMACEUTICA AG (CH) 2002-12-03 US disclosed
EP-1251827-A2 NASALLY ADMINISTRABLE CYCLIC PEPTIDE COMPOSITIONS Basilea Pharmaceutica AG (CH) 2002-10-30 EP disclosed
US-20010038824-A1 Intranasal cyclic peptide formulations BASILEA PHARMACEUTICA AG (CH) 2001-11-08 US disclosed
WO-2001052894-A2 NASALLY ADMINISTRABLE CYCLIC PEPTIDE COMPOSITIONS BASILEA PHARMACEUTICA AG (CH) 2001-07-26 WO disclosed
EP-1100816-A1 AEROTHRICIN ANALOGS, THEIR PREPARATION AND USE F. HOFFMANN-LA ROCHE AG (CH) 2001-05-23 EP disclosed
WO-2000005251-A1 AEROTHRICIN ANALOGS, THEIR PREPARATION AND USE F. HOFFMANN-LA ROCHE AG (CH) 2000-02-03 WO 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-20010038824-A1 Intranasal cyclic peptide formulations VIP, NPPA, SSTR5 MEN1 170/4885KMT2A 4834/4885CYP3A4 4325/4885

“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.