SCHEMBL6401443

SCHEMBL6401443

CCOc1ccccc1OCCCCCOc1coc(CO)cc1=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.53
NPC1 O15118 2/20 0.53
CYP1A2 P05177 2/20 0.53
CYP2C19 P33261 2/20 0.53
RECQL P46063 1/20 0.53
KMT2A Q03164 4/20 0.50
MEN1 O00255 2/20 0.50
L3MBTL1 Q9Y468 6/20 0.44
ALDH1A1 P00352 5/20 0.43
KDM4E B2RXH2 2/20 0.43
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
MAPT P10636 5/20 0.42
NPSR1 Q6W5P4 2/20 0.42
DAO P14920 3/20 0.42
TYR P14679 1/20 0.42
POLB P06746 2/20 0.40
LMNA P02545 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 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
SCHEMBL6395297 0.85 RAB9A (0.49) RAB9ANPC1CYP1A2CYP2C19RECQL
SCHEMBL8130767 0.85 RAB9A (0.56) RAB9ANPC1CYP1A2CYP2C19RECQL
SCHEMBL8129293 0.85 RAB9A (0.56) RAB9ANPC1CYP1A2CYP2C19RECQL
SCHEMBL8130837 0.85 RAB9A (0.56) RAB9ANPC1CYP1A2CYP2C19RECQL
SCHEMBL10494166 0.85 RAB9A (0.56) RAB9ANPC1CYP1A2CYP2C19RECQL
SCHEMBL8130917 0.85 RAB9A (0.56) RAB9ANPC1CYP1A2CYP2C19RECQL
SCHEMBL6550257 0.85 RAB9A (0.46) RAB9ANPC1CYP1A2CYP2C19RECQL
SCHEMBL6398164 0.84 DAO (0.53) RAB9ANPC1CYP1A2CYP2C19RECQL
SCHEMBL6900551 0.82 RAB9A (0.58) RAB9ANPC1CYP1A2CYP2C19RECQL
SCHEMBL6402963 0.81 MRGPRX4 (0.48) RAB9ANPC1KMT2AMEN1L3MBTL1

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-20050054629-A1 Compounds and methods of treating cell proliferative diseases EXONHIT THERAPEUTICS SA (FR) 2005-03-10 US claimed
US-6552073-B1 As anti-proliferative agent; for therapy of cancer EXONHIT THERAPEUTICS SA (FR) 2003-04-22 US claimed
US-20050054629-A1 Compounds and methods of treating cell proliferative diseases EXONHIT THERAPEUTICS SA (FR) 2005-03-10 US disclosed
EP-1480966-A1 COMPOUNDS AND METHODS OF TREATING CELL PROLIFERATIVE DISEASES Exonhit Therapeutics S.A. (FR) 2004-12-01 EP disclosed
WO-2003074508-A1 COMPOUNDS AND METHODS OF TREATING CELL PROLIFERATIVE DISEASES EXONHIT THERAPEUTICS SA (FR) 2003-09-12 WO disclosed
US-6552073-B1 As anti-proliferative agent; for therapy of cancer EXONHIT THERAPEUTICS SA (FR) 2003-04-22 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-20050054629-A1 Compounds and methods of treating cell proliferative diseases MKI67, CCNC, PCNA RAB9A 882/4885NPC1 151/4885CYP1A2 3570/4885

“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.