SCHEMBL6134438

SCHEMBL6134438

CCOC(=O)c1ccc(N2CCC(C3CCC(OCCCCCCOC)CC3)CC2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
ALDH1A1 P00352 8/20 0.43
TSHR P16473 1/20 0.42
HTT P42858 3/20 0.41
HPGD P15428 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
POLB P06746 1/20 0.41
GAA P10253 1/20 0.41
RAB9A P51151 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
FDFT1 P37268 1/20 0.40
HSP90AA1 P07900 1/20 0.40
CACNA1B Q00975 1/20 0.40
APBA1 Q02410 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
NPC1 O15118 1/20 0.40
MAPT P10636 1/20 0.40
MAPK1 P28482 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL6132246 0.95 HTT (0.44) MEN1KMT2AALDH1A1TSHRHTT
SCHEMBL6132393 0.95 HTT (0.44) MEN1KMT2AALDH1A1TSHRHTT
SCHEMBL6132432 0.88 ALDH1A1 (0.47) MEN1KMT2AALDH1A1TSHRHTT
SCHEMBL6132359 0.88 ALDH1A1 (0.47) MEN1KMT2AALDH1A1TSHRHTT
SCHEMBL6134505 0.86 GPR119 (0.41) MEN1KMT2AALDH1A1TSHRHPGD
SCHEMBL6134511 0.85 ALDH1A1 (0.47) MEN1KMT2AALDH1A1TSHRHTT
SCHEMBL6134525 0.84 HPGD (0.47) MEN1KMT2AALDH1A1TSHRHTT
SCHEMBL6134902 0.84 ALDH1A1 (0.50) KMT2AALDH1A1TSHRHTTHPGD
SCHEMBL6132749 0.83 HTT (0.43) MEN1KMT2AALDH1A1TSHRHTT
SCHEMBL6134811 0.82 ALDH1A1 (0.38) MEN1KMT2AALDH1A1TSHRHTT

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
US-20050261177-A1 Compound ASTELLAS PHARMA INC. (JP) 2005-11-24 US disclosed
EP-1366066-A2 CYCLOHEXAPEPTIDE HAVING ANTIMICROBIAL ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-12-03 EP disclosed
WO-2002072621-A2 CYCLOHEXAPEPTIDE HAVING ANTIMICROBIAL ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-09-19 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-20050261177-A1 Compound MANBA, MAN2B1, MAN2A1 MEN1 880/4885KMT2A 4492/4885ALDH1A1 3841/4885

“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.