SCHEMBL3901581

SCHEMBL3901581

CC(C)(CCN1CCCC1)c1nnc(N)s1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.50
ALDH1A1 P00352 5/20 0.38
GAA P10253 3/20 0.38
MAPK1 P28482 2/20 0.38
HSD17B10 Q99714 1/20 0.38
HPGD P15428 3/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
SMN1; SMN2 Q16637 3/20 0.34
ATM Q13315 1/20 0.32
GFER P55789 1/20 0.32
KDM4E B2RXH2 1/20 0.31
NPC1 O15118 1/20 0.31
TSHR P16473 1/20 0.31
RAB9A P51151 1/20 0.31
CYP2D6 P10635 3/20 0.31
POLB P06746 1/20 0.30
LMNA P02545 1/20 0.30
CHRM2 P08172 1/20 0.30
HTR1A P08908 1/20 0.30

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
Formic Acid SCHEMBL3912442 0.92 L3MBTL1 (0.43) L3MBTL1ALDH1A1GAAMAPK1HSD17B10
SCHEMBL3904032 0.87 L3MBTL1 (0.37) L3MBTL1ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL3910079 0.84 L3MBTL1 (0.45) L3MBTL1ALDH1A1GAAMAPK1HSD17B10
Formic Acid SCHEMBL3903450 0.80 MEN1 (0.39) L3MBTL1ALDH1A1GAAHSD17B10HPGD
SCHEMBL3901578 0.79 SMN1; SMN2 (0.36) L3MBTL1ALDH1A1GAAMAPK1HPGD
SCHEMBL3912438 0.75 SMN1; SMN2 (0.38) ALDH1A1MAPK1MEN1KMT2ASMN1; SMN2
Formic Acid SCHEMBL3912434 0.74 SMN1; SMN2 (0.33) L3MBTL1MEN1KMT2ASMN1; SMN2CYP2D6
SCHEMBL3902817 0.74 ALDH1A1 (0.47) L3MBTL1ALDH1A1GAASMN1; SMN2KDM4E
SCHEMBL9712886 0.73 ALDH1A1 (0.45) ALDH1A1GAAKDM4ENPC1RAB9A
SCHEMBL3901800 0.73 ALDH1A1 (0.45) ALDH1A1GAAHSD17B10KDM4ENPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070270426-A1 COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS PFIZER INC. 2007-11-22 US claimed
US-7253195-B2 Compounds for the treatment of neurodegenerative disorders PFIZER INC (US) 2007-08-07 US claimed
US-20050043372-A1 Compounds for the treatment of neurodegenerative disorders PFIZER, INC. (US) 2005-02-24 US claimed
EP-1658072-A4 COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS PFIZER PROD INC (US) 2009-03-25 EP disclosed
US-20080249094-A1 COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS PFIZER INC. 2008-10-09 US disclosed
US-7408068-B2 Compounds for the treatment of neurodegenerative disorders PFIZER INC. (US) 2008-08-05 US disclosed
US-20070270426-A1 COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS PFIZER INC. 2007-11-22 US disclosed
US-7253195-B2 Compounds for the treatment of neurodegenerative disorders PFIZER INC (US) 2007-08-07 US disclosed
EP-1658072-A1 COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS Pfizer Products Inc. (US) 2006-05-24 EP disclosed
WO-2005020991-A1 COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS PFIZER PRODUCTS, INC. (US) 2005-03-10 WO disclosed
US-20050043372-A1 Compounds for the treatment of neurodegenerative disorders PFIZER, INC. (US) 2005-02-24 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 (3 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-20070270426-A1 COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS APP, BACE1, PSEN1 L3MBTL1 584/4885ALDH1A1 2945/4885GAA 131/4885
US-20080249094-A1 COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS APP, BACE1, PSEN1 L3MBTL1 584/4885ALDH1A1 2945/4885GAA 131/4885
US-20050043372-A1 Compounds for the treatment of neurodegenerative disorders APP, BACE1, PSEN1 L3MBTL1 584/4885ALDH1A1 2945/4885GAA 131/4885

“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.