SCHEMBL3300574

SCHEMBL3300574

O=C(O)Cc1nnnn1C1CCCCC1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.58
ALDH1A1 P00352 6/20 0.56
MAPT P10636 2/20 0.56
TP53 P04637 1/20 0.56
HDAC1 Q13547 2/20 0.49
HDAC6 Q9UBN7 2/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
TSHR P16473 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
HSD11B1 P28845 1/20 0.48
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
NPSR1 Q6W5P4 1/20 0.45

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
SCHEMBL1975157 0.98 L3MBTL1 (0.56) L3MBTL1ALDH1A1MAPTTP53HDAC1
SCHEMBL3091807 0.81 ALDH1A1 (0.54) L3MBTL1ALDH1A1MAPTTP53HDAC1
SCHEMBL10676652 0.81 L3MBTL1 (0.52) L3MBTL1ALDH1A1MAPTTP53HDAC1
SCHEMBL9204606 0.80 ALDH1A1 (0.63) L3MBTL1ALDH1A1MAPTTP53HDAC1
SCHEMBL9204597 0.80 ALDH1A1 (0.63) L3MBTL1ALDH1A1MAPTTP53HDAC1
SCHEMBL10676355 0.79 L3MBTL1 (0.53) L3MBTL1ALDH1A1MAPTTP53HDAC1
SCHEMBL11395359 0.79 L3MBTL1 (0.50) L3MBTL1ALDH1A1MAPTTP53HDAC1
SCHEMBL3002913 0.78 ALDH1A1 (0.47) L3MBTL1ALDH1A1MAPTTP53HDAC1
SCHEMBL8888873 0.78 ALDH1A1 (0.60) L3MBTL1ALDH1A1MAPTTP53HDAC1
SCHEMBL8888879 0.78 ALDH1A1 (0.60) L3MBTL1ALDH1A1MAPTTP53HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7737163-B2 Benzimidazolone carboxylic acid derivatives PFIZER INC. (US) 2010-06-15 US disclosed
US-7705020-B2 Benzimidazolone carboxylic acid derivatives PFIZER INC. (US) 2010-04-27 US disclosed
US-7595329-B2 Benzimidazolone carboxylic acid derivatives PFIZER INC (US) 2009-09-29 US disclosed
US-20080108660-A1 Benzimidazolone Carboxylic Acid Derivatives PFIZER INC 2008-05-08 US disclosed
EP-1758891-A2 BENZIMIDAZOLONE CARBOXYLIC ACID DERIVATIVES Pfizer Japan Inc. (JP) 2007-03-07 EP disclosed
WO-2005123718-A2 BENZIMIDAZOLONE CARBOXYLIC ACID DERIVATIVES PFIZER JAPAN INC. (JP) 2005-12-29 WO disclosed
US-20050277672-A1 Benzimidazolone carboxylic acid derivatives PFIZER INC 2005-12-15 US disclosed
US-20050277671-A1 Benzimidazolone carboxylic acid derivatives PFIZER INC 2005-12-15 US disclosed
US-20050277673-A1 Benzimidazolone carboxylic acid derivatives PFIZER JAPAN INC. (JP) 2005-12-15 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 (4 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-20050277673-A1 Benzimidazolone carboxylic acid derivatives HRH2, HRH4, GPR4 L3MBTL1 3182/4885ALDH1A1 1109/4885MAPT 1910/4885
US-20050277672-A1 Benzimidazolone carboxylic acid derivatives HRH2, HRH4, GPR4 L3MBTL1 3182/4885ALDH1A1 1109/4885MAPT 1910/4885
US-20050277671-A1 Benzimidazolone carboxylic acid derivatives HRH2, HRH4, GPR4 L3MBTL1 3182/4885ALDH1A1 1109/4885MAPT 1910/4885
US-20080108660-A1 Benzimidazolone Carboxylic Acid Derivatives HRH2, HRH4, GPR4 L3MBTL1 3192/4885ALDH1A1 1018/4885MAPT 1535/4885

“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.