SCHEMBL6132342

SCHEMBL6132342

CCOC(=O)c1ccc(N2CCN(C3CCC(c4ccccc4)CC3)CC2)cc1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.54
KDM4E B2RXH2 8/20 0.54
TSHR P16473 1/20 0.51
POLB P06746 1/20 0.50
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
TRPV6 Q9H1D0 3/20 0.48
MAPT P10636 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
ORAI1 Q96D31 1/20 0.47
LMNA P02545 1/20 0.47
P2RX3 P56373 1/20 0.47
RECQL P46063 1/20 0.47
METAP1 P53582 1/20 0.46

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
SCHEMBL6132664 0.90 ALDH1A1 (0.56) ALDH1A1KDM4ETSHRMEN1KMT2A
SCHEMBL63474 0.89 ALDH1A1 (0.59) ALDH1A1KDM4ETSHRPOLBMEN1
SCHEMBL6132488 0.85 ALDH1A1 (0.55) ALDH1A1KDM4ETSHRPOLBMEN1
SCHEMBL6132519 0.85 ALDH1A1 (0.55) ALDH1A1KDM4ETSHRPOLBMEN1
SCHEMBL64407 0.85 ALDH1A1 (0.58) ALDH1A1TSHRPOLBMEN1KMT2A
SCHEMBL6132487 0.85 ALDH1A1 (0.55) ALDH1A1KDM4ETSHRPOLBMEN1
SCHEMBL6135228 0.85 ALDH1A1 (0.67) ALDH1A1TSHRPOLBMEN1KMT2A
SCHEMBL63892 0.85 ALDH1A1 (0.63) ALDH1A1TSHRPOLBMEN1KMT2A
SCHEMBL6134915 0.83 ALDH1A1 (0.65) ALDH1A1TSHRPOLBMEN1KMT2A
SCHEMBL6132216 0.83 MEN1 (0.70) ALDH1A1TSHRPOLBMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6884774-B2 Cyclic hexapeptide derivatives FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2005-04-26 US disclosed
EP-1259535-B1 CYCLIC HEXAPEPTIDE DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 2005-04-13 EP disclosed
US-20030083238-A1 Cyclic hexapeptide derivatives ASTELLAS PHARMA INC. (JP) 2003-05-01 US disclosed
EP-1259535-A1 CYCLIC HEXAPEPTIDE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-11-27 EP disclosed
WO-2001060846-A1 CYCLIC HEXAPEPTIDE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-08-23 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-20030083238-A1 Cyclic hexapeptide derivatives NGLY1, ALG1, CHIT1 ALDH1A1 4718/4885KDM4E 4687/4885TSHR 3037/4885

“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.