SCHEMBL4440505

SCHEMBL4440505

O=C(CCl)N1CCC2(CC1)CC2

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.50
HTT P42858 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
POLB P06746 1/20 0.47
LMNA P02545 1/20 0.40
CYP2D6 P10635 4/20 0.40
GPX4 P36969 1/20 0.39
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2C9 P11712 2/20 0.38
TSHR P16473 2/20 0.38
CYP2C19 P33261 1/20 0.38
CHRM2 P08172 1/20 0.37
CHRM3 P20309 1/20 0.37
RAB9A P51151 1/20 0.37
ITGB3 P05106 1/20 0.36
ITGA2B P08514 1/20 0.36

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
SCHEMBL5326103 0.91 ALDH1A1 (0.47) ALDH1A1HTTSMN1; SMN2POLBLMNA
SCHEMBL8904921 0.90 ALDH1A1 (0.46) ALDH1A1HTTSMN1; SMN2POLBLMNA
SCHEMBL4022870 0.80 ALDH1A1 (0.48) ALDH1A1HTTSMN1; SMN2POLBLMNA
SCHEMBL4438715 0.80 ALDH1A1 (0.53) ALDH1A1HTTSMN1; SMN2POLBLMNA
SCHEMBL9279972 0.80 ALDH1A1 (0.64) ALDH1A1HTTSMN1; SMN2POLBLMNA
SCHEMBL11844730 0.80
SCHEMBL8978116 0.80 ALDH1A1 (0.64) ALDH1A1HTTSMN1; SMN2POLBLMNA
SCHEMBL31117913 0.79 ALDH1A1 (0.50) ALDH1A1HTTSMN1; SMN2POLBCYP2D6
SCHEMBL15998851 0.77 ALDH1A1 (0.47) ALDH1A1CYP2D6CYP1A2CYP3A4CYP2C9
SCHEMBL224023 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2121656-A1 INHIBITORS OF SERINE PALMITOYLTRANSFERASE Pfizer Products Inc. (US) 2009-11-25 EP disclosed
US-20080287479-A1 INHIBITORS OF SERINE PALMITOYLTRANSFERASE PFIZER INC 2008-11-20 US disclosed
US-20080287479-A1 INHIBITORS OF SERINE PALMITOYLTRANSFERASE PFIZER INC 2008-11-20 US disclosed
US-20080287479-A1 INHIBITORS OF SERINE PALMITOYLTRANSFERASE PFIZER INC 2008-11-20 US disclosed
WO-2008084300-A1 INHIBITORS OF SERINE PALMITOYLTRANSFERASE PFIZER PRODUCTS INC. (US) 2008-07-17 WO disclosed
WO-2008084300-A1 INHIBITORS OF SERINE PALMITOYLTRANSFERASE PFIZER PRODUCTS INC. (US) 2008-07-17 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-20080287479-A1 INHIBITORS OF SERINE PALMITOYLTRANSFERASE SPTLC1, SPTLC2, CPT1A ALDH1A1 2622/4885HTT 4000/4885SMN1; SMN2 1145/4885

“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.