SCHEMBL695301

SCHEMBL695301

COc1ccccc1COCCCOc1ccc(C(=O)O)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.54
PKM P14618 1/20 0.54
MAPT P10636 3/20 0.53
LMNA P02545 2/20 0.53
RXRA P19793 1/20 0.52
PLA2G4B P0C869 1/20 0.51
REN P00797 2/20 0.50
HPGD P15428 2/20 0.50
RARB P10826 1/20 0.50
ATM Q13315 1/20 0.50
NR4A2 P43354 2/20 0.49
TP53 P04637 1/20 0.49
TSHR P16473 1/20 0.49
NPC1 O15118 1/20 0.48
POLB P06746 1/20 0.48
RAB9A P51151 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
NR4A1 P22736 1/20 0.48
NR4A3 Q92570 1/20 0.48
ALKBH1 Q13686 1/20 0.47

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
SCHEMBL694844 0.94 PKM (0.59) L3MBTL1PKMMAPTLMNARXRA
SCHEMBL10690676 0.86 L3MBTL1 (0.65) L3MBTL1PKMMAPTLMNARXRA
SCHEMBL695665 0.82 MAPT (0.63) L3MBTL1MAPTLMNAHPGDNPC1
SCHEMBL5710536 0.81 MAPT (0.51) L3MBTL1MAPTRENHPGDATM
SCHEMBL5710347 0.81 MAPT (0.51) L3MBTL1MAPTRENHPGDATM
SCHEMBL6721777 0.81 MAPT (0.51) L3MBTL1MAPTRENHPGDATM
SCHEMBL3651157 0.81 MAPT (0.51) L3MBTL1MAPTLMNARENHPGD
SCHEMBL5710640 0.80 LTA4H (0.52) L3MBTL1MAPTLMNARENHPGD
SCHEMBL16517520 0.79 TSHR (0.57) L3MBTL1MAPTLMNARXRAHPGD
Bicarbonate SCHEMBL7436723 0.77 REN (0.55) REN

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-20120115907-A1 NOVEL COMPOUNDS AS INHIBITORS OF RENIN CADILA HEALTHCARE LIMITED (IN) 2012-05-10 US disclosed
EP-2421828-A2 PIPERIDINE DERIVATIVES AS INHIBITORS OF RENIN Cadila Healthcare Limited (IN) 2012-02-29 EP disclosed
WO-2010122580-A2 NOVEL COMPOUNDS AS INHIBITORS OF RENIN CADILA HEALTHCARE LIMITED (IN) 2010-10-28 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-20120115907-A1 NOVEL COMPOUNDS AS INHIBITORS OF RENIN REN, ACE, AGTR1 L3MBTL1 4879/4885PKM 543/4885MAPT 202/4885

“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.