SCHEMBL21815469

SCHEMBL21815469

N#Cc1ccc(OP(=O)(Oc2ccc(C#N)cc2)c2ccccc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.66
L3MBTL1 Q9Y468 1/20 0.66
CA1 P00915 10/20 0.54
CA2 P00918 10/20 0.54
CA9 Q16790 10/20 0.54
CA12 O43570 9/20 0.54
CA4 P22748 9/20 0.54
CA5A P35218 9/20 0.54
CA7 P43166 9/20 0.54
CA5B Q9Y2D0 9/20 0.54
CYP1A2 P05177 1/20 0.48
CYP2C19 P33261 1/20 0.48
MAOB P27338 2/20 0.47
TSHR P16473 1/20 0.45
MEN1 O00255 2/20 0.41
RAB9A P51151 2/20 0.41
KMT2A Q03164 2/20 0.41
F2 P00734 1/20 0.41
PLG P00747 1/20 0.41
PLAU P00749 1/20 0.41

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
SCHEMBL28100894 0.93 TDP1 (0.66) TDP1L3MBTL1CA1CA2CA9
SCHEMBL28383839 0.86 MAOB (0.47) TDP1L3MBTL1CA1CA2CA9
SCHEMBL28460825 0.81 MAOB (0.50) TDP1L3MBTL1CA1CA2CA9
SCHEMBL561190 0.80 L3MBTL1 (1.00) TDP1L3MBTL1CA1CA2CA9
SCHEMBL8804099 0.79 CA1 (0.58) TDP1L3MBTL1CA1CA2CA9
Carbon Monoxide SCHEMBL6562620 0.79 L3MBTL1 (0.87) TDP1L3MBTL1CA1CA2CA9
SCHEMBL8804107 0.79 MAOB (0.47) TDP1L3MBTL1CA1CA2CA9
SCHEMBL30525949 0.77 KDM4E (0.50) CA1CA2CA9MAOBTSHR
SCHEMBL8804102 0.77 MAOB (0.46) TDP1L3MBTL1CA1CA2CA9
SCHEMBL9164159 0.77 TDP1 (0.83) TDP1L3MBTL1CA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260137765-A1 METHODS OF PRODUCING SHIGA TOXIN B-SUBUNIT (STXB) MONOMERS AND OLIGOMERS, AND USES THEREOF INSTITUT CURIE (FR) 2026-05-21 US disclosed
US-12527854-B2 Methods of producing Shiga toxin B-subunit (STxB) monomers and oligomers, and uses thereof INSTITUT CURIE (FR) 2026-01-20 US disclosed
EP-3856164-B1 MORPHIC FORMS OF COMPLEMENT FACTOR D INHIBITORS ACHILLION PHARMACEUTICALS INC (US) 2024-08-07 EP disclosed
US-11807627-B2 Morphic forms of complement factor D inhibitors Achillon Pharmaceuticals, Inc. (US) 2023-11-07 US disclosed
US-20220233673-A1 METHODS OF PRODUCING SHIGA TOXIN B-SUBUNIT (STxB) MONOMERS AND OLIGOMERS, AND USES THEREOF INSTITUT CURIE (FR) 2022-07-28 US disclosed
US-20210332026-A1 MORPHIC FORMS OF COMPLEMENT FACTOR D INHIBITORS ACHILLION PHARMACEUTICALS, INC. (US) 2021-10-28 US disclosed
EP-3856164-A1 MORPHIC FORMS OF COMPLEMENT FACTOR D INHIBITORS Achillion Pharmaceuticals, Inc. (US) 2021-08-04 EP disclosed
CN-112996497-A Morphic forms of complement factor D inhibitors 艾其林医药公司 2021-06-18 CN disclosed
WO-2020069024-A1 MORPHIC FORMS OF COMPLEMENT FACTOR D INHIBITORS ACHILLION PHARMACEUTICALS, INC. (US) 2020-04-02 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 (4 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-12527854-B2 Methods of producing Shiga toxin B-subunit (STxB) monomers and oligomers, and uses thereof STXBP1, RNGTT, UPF1 TDP1 3420/4885L3MBTL1 76/4885CA1 4068/4885
US-11807627-B2 Morphic forms of complement factor D inhibitors CFD, CFH, CFB TDP1 4078/4885L3MBTL1 2894/4885CA1 4405/4885
US-20260137765-A1 METHODS OF PRODUCING SHIGA TOXIN B-SUBUNIT (STXB) MONOMERS AND OLIGOMERS, AND USES THEREOF STXBP1, HBB, UPF1 TDP1 3681/4885L3MBTL1 135/4885CA1 3497/4885
US-20210332026-A1 MORPHIC FORMS OF COMPLEMENT FACTOR D INHIBITORS CFD, CFH, CFB TDP1 4078/4885L3MBTL1 2894/4885CA1 4405/4885

“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.