SCHEMBL19203897

SCHEMBL19203897

Cc1nc2c(ccn2COCC[Si](C)(C)C)cc1N=C(c1ccccc1)c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.34
KLKB1 P03952 1/20 0.33
DGAT1 O75907 5/20 0.32

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
SCHEMBL20767611 0.85 NPC1 (0.32) NPC1DGAT1
SCHEMBL29896746 0.85 NPC1 (0.32) NPC1DGAT1
SCHEMBL23229294 0.75 DGAT1 (0.34) NPC1DGAT1
SCHEMBL19203911 0.75 DGAT1 (0.41) NPC1KLKB1DGAT1
SCHEMBL20401183 0.73 NPC1 (0.39) NPC1DGAT1
SCHEMBL20699444 0.72 KMT2A (0.41) NPC1KLKB1DGAT1
SCHEMBL19204028 0.70 DGAT1 (0.34) NPC1KLKB1DGAT1
SCHEMBL2376935 0.69 DGAT1 (0.36) NPC1KLKB1DGAT1
SCHEMBL21751708 0.69 DGAT1 (0.38) NPC1KLKB1DGAT1
SCHEMBL20767635 0.69 NPC1 (0.35) NPC1KLKB1DGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220372042-A1 CONDENSED HETEROCYCLES AS BCL-2 INHIBITORS NEWAVE PHARMACEUTICAL INC. 2022-11-24 US disclosed
US-20210315904-A1 BCL-2 INHIBITORS NEWAVE PHARMACEUTICAL INC. 2021-10-14 US disclosed
US-20210171523-A1 BCL-2 INHIBITORS NEWAVE PHARMACEUTICAL INC (US) 2021-06-10 US disclosed
US-20200071329-A1 BCL-2 INHIBITORS NEWAVE PHARMACEUTICAL INC. 2020-03-05 US disclosed
US-10377755-B2 BCL-2 inhibitors NEWAVE PHARMACEUTICAL INC. (US) 2019-08-13 US disclosed
US-20190040062-A1 BCL-2 INHIBITORS NEWAVE PHARMACEUTICAL INC. 2019-02-07 US disclosed
WO-2017132474-A1 BCL-2 INHIBITORS NEWAVE PHARMACEUTICAL INC. (US) 2017-08-03 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 (6 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-10377755-B2 BCL-2 inhibitors BCL2L1, BCL2, BCL2A1 NPC1 2259/4885KLKB1 4534/4885DGAT1 2751/4885
US-20200071329-A1 BCL-2 INHIBITORS BCL2L1, BCL2, BCL2A1 NPC1 2259/4885KLKB1 4534/4885DGAT1 2751/4885
US-20210315904-A1 BCL-2 INHIBITORS BCL2L10, BCL2, BCL2L11 NPC1 3788/4885KLKB1 3570/4885DGAT1 4227/4885
US-20210171523-A1 BCL-2 INHIBITORS BCL2L1, BCL2, BCL2A1 NPC1 2259/4885KLKB1 4534/4885DGAT1 2751/4885
US-20220372042-A1 CONDENSED HETEROCYCLES AS BCL-2 INHIBITORS BCL2L11, BCL2L10, BCL2 NPC1 3924/4885KLKB1 2992/4885DGAT1 4510/4885
US-20190040062-A1 BCL-2 INHIBITORS BCL2L1, BCL2, BCL2A1 NPC1 2259/4885KLKB1 4534/4885DGAT1 2751/4885

“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.