SCHEMBL3912438

SCHEMBL3912438

CC(C)(CCN1CCCC1)c1nnc(NC=O)s1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.38
CYP2D6 P10635 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
CYP1A2 P05177 1/20 0.34
FPR3 P25089 1/20 0.32
FPR2 P25090 1/20 0.32
ALDH1A1 P00352 1/20 0.31
MAPK1 P28482 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
SCHEMBL3903446 0.89 MEN1 (0.39) SMN1; SMN2MEN1KMT2ACYP1A2ALDH1A1
Formic Acid SCHEMBL3912442 0.76 L3MBTL1 (0.43) SMN1; SMN2CYP2D6MEN1KMT2AALDH1A1
SCHEMBL3901581 0.75 L3MBTL1 (0.50) SMN1; SMN2CYP2D6MEN1KMT2AALDH1A1
SCHEMBL3909252 0.74 CNR2 (0.32) SMN1; SMN2MEN1KMT2ACYP1A2
Formic Acid SCHEMBL3912434 0.73 SMN1; SMN2 (0.33) SMN1; SMN2CYP2D6MEN1KMT2A
SCHEMBL3901578 0.72 SMN1; SMN2 (0.36) SMN1; SMN2CYP2D6MEN1KMT2AALDH1A1
SCHEMBL9893162 0.71 CA1 (0.53) SMN1; SMN2MEN1KMT2ACYP1A2ALDH1A1
SCHEMBL2441632 0.69 SMN1; SMN2 (0.40) SMN1; SMN2MEN1KMT2ACYP1A2ALDH1A1
SCHEMBL2446415 0.65 CA1 (0.53) SMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL3904032 0.63 L3MBTL1 (0.37) SMN1; SMN2MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1658072-A4 COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS PFIZER PROD INC (US) 2009-03-25 EP 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 (2 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 SMN1; SMN2 47/4885CYP2D6 4298/4885MEN1 1488/4885
US-20050043372-A1 Compounds for the treatment of neurodegenerative disorders APP, BACE1, PSEN1 SMN1; SMN2 47/4885CYP2D6 4298/4885MEN1 1488/4885

“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.