SCHEMBL17798306

SCHEMBL17798306

CC(C)(C)OC(=O)N1CCc2c(OCC[Si](c3ccccc3)(c3ccccc3)C(C)(C)C)ccc(Br)c2C1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 5/20 0.40
PPARG P37231 2/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
KDM4E B2RXH2 1/20 0.38
PKM P14618 1/20 0.38
BCHE P06276 2/20 0.38
HTR6 P50406 2/20 0.38
MKNK1 Q9BUB5 3/20 0.38
MAPT P10636 1/20 0.37
ACACB O00763 1/20 0.37
PPARA Q07869 1/20 0.37
UCHL1 P09936 1/20 0.36
GRM5 P41594 1/20 0.36
GRM1 Q13255 1/20 0.36

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
SCHEMBL17798889 0.88 P2RX3 (0.38) P2RX3PPARGHDAC1HDAC6KDM4E
SCHEMBL5442181 0.83 ESR2 (0.42) P2RX3PPARGHDAC1HDAC6KDM4E
SCHEMBL30329765 0.82 P2RX3 (0.45) P2RX3HDAC1HDAC6BCHEHTR6
SCHEMBL5090357 0.82 P2RX3 (0.45) P2RX3HDAC1HDAC6BCHEHTR6
SCHEMBL5456815 0.78 KDM4E (0.47) P2RX3HDAC1HDAC6KDM4EMKNK1
SCHEMBL17798856 0.75 BCL2L1 (0.31)
SCHEMBL17798393 0.74 HRH3 (0.32) HTR6
SCHEMBL16518060 0.73 CYP1A2 (0.47) P2RX3HDAC1HDAC6KDM4EMKNK1
SCHEMBL5093863 0.73 ESR2 (0.51) HDAC1HDAC6KDM4EMKNK1MAPT
SCHEMBL15056844 0.72 ESR2 (0.47) P2RX3HDAC1HDAC6KDM4EMKNK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250263491-A1 ANTI-EGFR ANTIBODY DRUG CONJUGATES ABBVIE INC (US) 2025-08-21 US disclosed
US-20230120736-A1 ANTI-CD98 ANTIBODIES AND ANTIBODY DRUG CONJUGATES ABBVIE INC (US) 2023-04-20 US disclosed
US-20230114718-A1 ANTI-EGFR ANTIBODY DRUG CONJUGATES ABBVIE INC (US) 2023-04-13 US disclosed
US-20200338209-A1 ANTI-B7-H3 ANTIBODIES AND ANTIBODY DRUG CONJUGATES ABBVIE INC (US) 2020-10-29 US disclosed
US-20200239553-A1 BCL-XL Inhibitory Compounds and Antibody Drug Conjugates Including the Same ABBVIE INC. (US) 2020-07-30 US disclosed
US-20200147235-A1 ANTI-CD98 ANTIBODIES AND ANTIBODY DRUG CONJUGATES ABBVIE INC. 2020-05-14 US disclosed
US-20190153108-A1 ANTI-EGFR ANTIBODY DRUG CONJUGATES ABBVIE INC. (US) 2019-05-23 US disclosed
EP-3469000-A1 ANTI-B7-H3 ANTIBODIES AND ANTIBODY DRUG CONJUGATES AbbVie Inc. (US) 2019-04-17 EP disclosed
EP-3468616-A1 ANTI-EGFR ANTIBODY DRUG CONJUGATES AbbVie Inc. (US) 2019-04-17 EP disclosed
EP-3468599-A2 ANTI-CD98 ANTIBODIES AND ANTIBODY DRUG CONJUGATES AbbVie Inc. (US) 2019-04-17 EP disclosed
WO-2017214301-A1 ANTI-EGFR ANTIBODY DRUG CONJUGATES ABBVIE INC. (US) 2017-12-14 WO disclosed
WO-2017214458-A2 ANTI-CD98 ANTIBODIES AND ANTIBODY DRUG CONJUGATES ABBVIE INC. (US) 2017-12-14 WO disclosed
EP-3230283-A1 BCL-XL INHIBITORY COMPOUNDS AND ANTIBODY DRUG CONJUGATES INCLUDING THE SAME AbbVie Inc. (US) 2017-10-18 EP disclosed
WO-2016094517-A1 BCL-XL INHIBITORY COMPOUNDS AND ANTIBODY DRUG CONJUGATES INCLUDING THE SAME ABBVIE INC. (US) 2016-06-16 WO disclosed
US-20160158377-A1 BCL-XL Inhibitory Compounds and Antibody Drug Conjugates Including the Same ABBVIE INC. (US) 2016-06-09 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 (8 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-20200239553-A1 BCL-XL Inhibitory Compounds and Antibody Drug Conjugates Including the Same BCL2, BCL2L10, BAX P2RX3 4576/4885PPARG 3258/4885HDAC1 764/4885
US-20230114718-A1 ANTI-EGFR ANTIBODY DRUG CONJUGATES EGFR, ERBB2, ERBB3 P2RX3 4120/4885PPARG 2536/4885HDAC1 3668/4885
US-20200338209-A1 ANTI-B7-H3 ANTIBODIES AND ANTIBODY DRUG CONJUGATES HRH3, H1-3, CD274 P2RX3 2582/4885PPARG 4417/4885HDAC1 928/4885
US-20250263491-A1 ANTI-EGFR ANTIBODY DRUG CONJUGATES EGFR, ERBB2, ERBB3 P2RX3 4120/4885PPARG 2536/4885HDAC1 3668/4885
US-20230120736-A1 ANTI-CD98 ANTIBODIES AND ANTIBODY DRUG CONJUGATES CD99, SLC3A2, CD63 P2RX3 3527/4885PPARG 4237/4885HDAC1 3380/4885
US-20200147235-A1 ANTI-CD98 ANTIBODIES AND ANTIBODY DRUG CONJUGATES CD99, SLC3A2, CD63 P2RX3 3527/4885PPARG 4237/4885HDAC1 3380/4885
US-20160158377-A1 BCL-XL Inhibitory Compounds and Antibody Drug Conjugates Including the Same BCL2, BCL2L10, BAX P2RX3 4576/4885PPARG 3258/4885HDAC1 764/4885
US-20190153108-A1 ANTI-EGFR ANTIBODY DRUG CONJUGATES EGFR, ERBB2, ERBB3 P2RX3 4120/4885PPARG 2536/4885HDAC1 3668/4885

“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.