SCHEMBL19683919

SCHEMBL19683919

CCCCOCC[C@H]1CO[C@H](OC)C(=O)O1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.45
ALDH1A1 P00352 6/20 0.40
TDP1 Q9NUW8 1/20 0.40
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
CYP1A2 P05177 2/20 0.34
SPHK2 Q9NRA0 1/20 0.32
SPHK1 Q9NYA1 1/20 0.32
LMNA P02545 2/20 0.32
KDM4E B2RXH2 1/20 0.32
TSHR P16473 3/20 0.32
PPARG P37231 1/20 0.32
GRM2 Q14416 1/20 0.31
CYP3A4 P08684 3/20 0.30
CYP2D6 P10635 2/20 0.30
CYP2C19 P33261 2/20 0.30
CYP2C9 P11712 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
SCHEMBL19683920 1.00 SMN1; SMN2 (0.45) SMN1; SMN2ALDH1A1TDP1MEN1KMT2A
SCHEMBL19678570 0.84 ALDH1A1 (0.33) SMN1; SMN2ALDH1A1KMT2ACYP1A2KDM4E
SCHEMBL19678564 0.84 ALDH1A1 (0.33) SMN1; SMN2ALDH1A1KMT2ACYP1A2KDM4E
SCHEMBL3624389 0.77 SMN1; SMN2 (0.67) SMN1; SMN2ALDH1A1TDP1MEN1KMT2A
SCHEMBL7924840 0.77 SMN1; SMN2 (0.67) SMN1; SMN2ALDH1A1TDP1MEN1KMT2A
SCHEMBL3623198 0.71 ALDH1A1 (0.66) SMN1; SMN2ALDH1A1TDP1MEN1KMT2A
SCHEMBL21142107 0.71 SMN1; SMN2 (0.69) SMN1; SMN2ALDH1A1TDP1MEN1KMT2A
SCHEMBL10406971 0.70 ALDH1A1 (0.69) SMN1; SMN2ALDH1A1TDP1MEN1KMT2A
SCHEMBL3624599 0.70 ALDH1A1 (0.69) SMN1; SMN2ALDH1A1TDP1MEN1KMT2A
SCHEMBL3622120 0.70 ALDH1A1 (0.69) SMN1; SMN2ALDH1A1TDP1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017214024-A1 SILVESTROL ANTIBODY-DRUG CONJUGATES AND METHODS OF USE GENENTECH, INC. (US) 2017-12-14 WO disclosed
US-20170348422-A1 SILVESTROL ANTIBODY-DRUG CONJUGATES AND METHODS OF USE GENENTECH, INC. (US) 2017-12-07 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 (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-20170348422-A1 SILVESTROL ANTIBODY-DRUG CONJUGATES AND METHODS OF USE SHBG, EPCAM, ITGAV SMN1; SMN2 3848/4885ALDH1A1 191/4885TDP1 4756/4885

“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.