SCHEMBL6132274

SCHEMBL6132274

CC1CCC(N2CCN(c3ccc(C(=O)NN)cn3)CC2)CC1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.53
ALDH1A1 P00352 6/20 0.53
SMN1; SMN2 Q16637 6/20 0.53
NPC1 O15118 5/20 0.53
TSHR P16473 2/20 0.53
MAPT P10636 2/20 0.53
LMNA P02545 1/20 0.53
HPGD P15428 5/20 0.52
PKM P14618 1/20 0.52
HRH3 Q9Y5N1 6/20 0.51
HDAC1 Q13547 1/20 0.48
KDM4E B2RXH2 2/20 0.47
MAPK1 P28482 2/20 0.47
CXCR3 P49682 1/20 0.47
ADRA1A P35348 4/20 0.46
TP53 P04637 1/20 0.45
HTT P42858 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
HPGDS O60760 1/20 0.43

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
SCHEMBL6132270 1.00 RAB9A (0.53) RAB9AALDH1A1SMN1; SMN2NPC1TSHR
SCHEMBL6132424 0.89 HRH3 (0.49) RAB9AALDH1A1SMN1; SMN2NPC1TSHR
SCHEMBL6132366 0.89 HRH3 (0.49) RAB9AALDH1A1SMN1; SMN2NPC1TSHR
SCHEMBL6132267 0.85 HRH3 (0.64) RAB9AALDH1A1SMN1; SMN2NPC1TSHR
SCHEMBL6132220 0.85 HRH3 (0.64) RAB9AALDH1A1SMN1; SMN2NPC1TSHR
SCHEMBL6132223 0.85 HRH3 (0.64) RAB9AALDH1A1SMN1; SMN2NPC1TSHR
SCHEMBL6132283 0.82 MEN1 (0.55) SMN1; SMN2KDM4E
SCHEMBL6117792 0.80 HRH3 (0.66) RAB9ASMN1; SMN2NPC1MAPTHRH3
SCHEMBL5638622 0.80 RAB9A (0.60) RAB9AALDH1A1SMN1; SMN2NPC1HPGD
SCHEMBL3598305 0.78 UBE2T (0.60) RAB9AALDH1A1SMN1; SMN2NPC1TSHR

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 6 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
CN-1425026-A Cyclic hexapeptide derivatives FUJISAWA PHARMACEUTICAL CO (JP) 2003-06-18 CN 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 RAB9A 3506/4885ALDH1A1 4718/4885SMN1; SMN2 3679/4885

“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.