SCHEMBL19684096

SCHEMBL19684096

BC(=O)OCc1ccc(NC(=O)CNC(=O)C2(C(=O)NCCCCCN3C(=O)CC(C(CC)CC)C3=O)CCC2)cc1

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ PSEN1 P49768 3/20 0.33
▸ PSEN2 P49810 3/20 0.33
▸ APH1B Q8WW43 3/20 0.33
▸ NCSTN Q92542 3/20 0.33
▸ APH1A Q96BI3 3/20 0.33
▸ PSENEN Q9NZ42 3/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ FOLH1 Q04609 1/20 0.31
▸ HPGD P15428 1/20 0.30
▸ FPR3 P25089 1/20 0.30
▸ FPR2 P25090 1/20 0.30
▸ MAPT P10636 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
SCHEMBL19698830 0.93 ALDH1A1 (0.33) MEN1KMT2AALDH1A1PSEN1PSEN2
SCHEMBL21949515 0.91 MEN1 (0.34) MEN1KMT2AALDH1A1PSEN1PSEN2
SCHEMBL23889723 0.88 PSEN1 (0.34) MEN1KMT2AALDH1A1PSEN1PSEN2
SCHEMBL19683917 0.85 SMN1; SMN2 (0.36) MEN1KMT2AALDH1A1SMN1; SMN2HPGD
SCHEMBL19684092 0.84 MEN1 (0.34) MEN1KMT2AALDH1A1PSEN1PSEN2
SCHEMBL23889705 0.83 RAB9A (0.34) MEN1KMT2AALDH1A1PSEN1PSEN2
SCHEMBL22219876 0.79 HTR1A (0.36) MEN1KMT2AALDH1A1SMN1; SMN2HPGD
SCHEMBL19698817 0.77 PKM (0.36) MEN1KMT2AALDH1A1SMN1; SMN2HPGD
SCHEMBL19684093 0.76 SMN1; SMN2 (0.40) MEN1KMT2AALDH1A1SMN1; SMN2HPGD
SCHEMBL23020008 0.76 OPRM1 (0.35) PSEN1PSEN2APH1BNCSTNAPH1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 MEN1 3118/4885KMT2A 503/4885ALDH1A1 191/4885

“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.

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