SCHEMBL4024748

SCHEMBL4024748

CC[Si](CC)(CC)Oc1cc(C(C)=O)ccc1S(=O)(=O)c1ccc(C(C)=O)cc1O[Si](CC)(CC)CC

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.36
ALDH1A1 P00352 4/20 0.35
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
HTT P42858 1/20 0.35
CDK1 P06493 1/20 0.35
STS P08842 1/20 0.34
PKM P14618 1/20 0.34
HIF1A Q16665 1/20 0.34

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
SCHEMBL3939214 0.77 TRPV4 (0.46) SMN1; SMN2HTT
SCHEMBL4098349 0.77 KDM4E (0.40) SMN1; SMN2ALDH1A1KMT2AHTTPKM
SCHEMBL3938424 0.76 L3MBTL1 (0.43) SMN1; SMN2ALDH1A1
SCHEMBL3938488 0.75 ALPL (0.38) ALDH1A1KMT2AMEN1
SCHEMBL3939973 0.73 HTR6 (0.44) ALDH1A1KMT2AMEN1HTT
SCHEMBL12995947 0.69 KMT2A (0.54) SMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL24798771 0.67 LMNA (0.50) SMN1; SMN2ALDH1A1KMT2AMEN1HTT
SCHEMBL25139750 0.66 PKM (0.58) SMN1; SMN2ALDH1A1KMT2AMEN1HTT
SCHEMBL15778442 0.66 ALDH1A1 (0.49) CREBBPSMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL26073978 0.66 TRPV4 (0.60) SMN1; SMN2ALDH1A1KMT2AMEN1HTT

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-1419143-B1 24-SULFUR-SUBSTITUTED ANALOGS OF 1ALPHA,25-DIHYDROXY VITAMIN D3 UNIV JOHNS HOPKINS (US) 2009-04-15 EP disclosed
US-7166585-B2 24-Sulfur-substituted analogs of 1α,25-dihydroxy vitamin D3 CYTOCHROMA INC. (CA) 2007-01-23 US disclosed
US-20040132695-A1 24-Sulfur-substituted analogs of 1 alpha, 25-dihydroxy vitamin D3 NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2004-07-08 US disclosed
EP-1419143-A1 24-SULFUR-SUBSTITUTED ANALOGS OF 1ALPHA,25-DIHYDROXY VITAMIN D3 JOHNS HOPKINS UNIVERSITY (US) 2004-05-19 EP disclosed
US-20030149005-A1 24-sulfur-substituted analogs of 1alpha, 25-dihydroxy vitamin D3 Opko IP Holdings II, Inc. (KY) 2003-08-07 US disclosed
WO-2003018545-A1 24-SULFUR-SUBSTITUTED ANALOGS OF 1Α,25-DIHYDROXY VITAMIN D¿3? JOHNS HOPKINS UNIVERSITY (US) 2003-03-06 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 (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-20030149005-A1 24-sulfur-substituted analogs of 1alpha, 25-dihydroxy vitamin D3 CYP24A1, CYP2R1, CYP27B1 CREBBP 3495/4885SMN1; SMN2 2590/4885ALDH1A1 333/4885
US-20040132695-A1 24-Sulfur-substituted analogs of 1 alpha, 25-dihydroxy vitamin D3 CYP24A1, CYP2R1, CYP27B1 CREBBP 3988/4885SMN1; SMN2 2475/4885ALDH1A1 277/4885

“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.