SCHEMBL6204829

SCHEMBL6204829

O=C1OCc2cc3c(cc21)OCCO3

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.52
MAPT P10636 2/20 0.48
LMNA P02545 2/20 0.48
GAA P10253 1/20 0.48
MAOA P21397 8/20 0.47
MAOB P27338 7/20 0.47
PRF1 P14222 3/20 0.43
RECQL P46063 1/20 0.43
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 2/20 0.40
TYMS P04818 1/20 0.40
CYP1A2 P05177 1/20 0.40
HPGD P15428 1/20 0.40
CYP2C19 P33261 1/20 0.40
HSD17B10 Q99714 1/20 0.40
KCNJ1 P48048 1/20 0.39
KCNH2 Q12809 1/20 0.39
ACHE P22303 1/20 0.37

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
SCHEMBL6200324 0.88 CYP3A4 (0.52) CYP3A4MAPTLMNAGAAMAOA
SCHEMBL13412837 0.82 CYP3A4 (0.63) CYP3A4MAPTLMNAGAAMAOA
SCHEMBL30773512 0.75 ALOX5 (0.50) CYP3A4MAPTLMNAGAAMAOA
SCHEMBL11658971 0.73 LMNA (0.43) MAPTLMNAGAAALDH1A1KDM4E
SCHEMBL855514 0.72 CYP3A4 (0.53) CYP3A4MAPTLMNAGAAMAOA
SCHEMBL32673168 0.72 CYP3A4 (0.53) CYP3A4MAPTLMNAGAAMAOA
SCHEMBL25546732 0.72 CYP3A4 (0.58) CYP3A4MAPTLMNAGAAMAOA
SCHEMBL1608218 0.72 CYP3A4 (0.53) CYP3A4MAPTLMNAGAAMAOA
SCHEMBL854481 0.72 CYP3A4 (0.53) CYP3A4MAPTLMNAGAAMAOA
SCHEMBL78883 0.72 CYP3A4 (0.53) CYP3A4MAPTLMNAGAAMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1266887-B1 Indenoindoline derivatives, their process of preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2005-08-17 EP disclosed
US-6627650-B2 An isomer thereof, or an addition salt thereof with a pharmaceutically acceptable acid or base. Medicinal products containing the same which are useful as anti- cancer agents. LES LABORATOIRES SERVIER (FR) 2003-09-30 US disclosed
US-20030125369-A1 Indeno(1,2-b)indole oximes or indeno(1,2-b) indole hydrazones used as anticancer agent LES LABORATOIRES SERVIER (FR) 2003-07-03 US disclosed
EP-1266887-A2 Indenoindoline derivatives, their process of preparation and pharmaceutical compositions containing them Les Laboratoires Servier (FR) 2002-12-18 EP 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-20030125369-A1 Indeno(1,2-b)indole oximes or indeno(1,2-b) indole hydrazones used as anticancer agent IDO1, IDO2, AHR CYP3A4 390/4885MAPT 4727/4885LMNA 3971/4885

“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.