SCHEMBL4884780

SCHEMBL4884780

O[C@@H]1CCN(C(=S)Nc2ccc(Cl)cc2)C1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.62
LMNA P02545 8/20 0.60
GAA P10253 1/20 0.57
MAPT P10636 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
POLB P06746 1/20 0.57
HTT P42858 3/20 0.57
NPSR1 Q6W5P4 1/20 0.54
ALDH1A1 P00352 2/20 0.51
RAB9A P51151 1/20 0.51
GLA P06280 1/20 0.50
TDP1 Q9NUW8 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48

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
SCHEMBL4877647 0.91 SMN1; SMN2 (0.71) SMN1; SMN2LMNAGAAMAPTL3MBTL1
SCHEMBL14066248 0.84 LMNA (0.73) SMN1; SMN2LMNAGAAMAPTL3MBTL1
SCHEMBL316088 0.75 POLB (0.60) SMN1; SMN2LMNAGAAMAPTL3MBTL1
SCHEMBL17730081 0.75 ALOX5 (0.71) SMN1; SMN2LMNAGAAMAPTRAB9A
SCHEMBL4715420 0.74 KMT2A (0.61) SMN1; SMN2LMNAMAPTPOLBHTT
SCHEMBL4126374 0.73 SMN1; SMN2 (0.52) SMN1; SMN2LMNAGAAMAPTL3MBTL1
SCHEMBL14119932 0.73 LMNA (1.00) SMN1; SMN2LMNAGAAMAPTPOLB
SCHEMBL5159206 0.72 SMN1; SMN2 (0.57) SMN1; SMN2LMNAGAAMAPTPOLB
SCHEMBL23747426 0.72 RAB9A (0.53) POLBRAB9AMEN1KMT2A
SCHEMBL15919893 0.72 NPY2R (0.76) SMN1; SMN2LMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080234252-A1 Compounds Useful in Therapy PFIZER INC 2008-09-25 US disclosed
US-20080234252-A1 Compounds Useful in Therapy PFIZER INC 2008-09-25 US disclosed
US-20080234252-A1 Compounds Useful in Therapy PFIZER INC 2008-09-25 US disclosed
WO-2006123242-A1 1, 2, 4 -TRIAZOLE DERIVATIVES AS VASOPRESSIN ANTAGONISTS PFIZER LIMITED (GB) 2006-11-23 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-20080234252-A1 Compounds Useful in Therapy AVPR1A, AVPR1B, AVPR2 SMN1; SMN2 2757/4885LMNA 1476/4885GAA 4597/4885

“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.