SCHEMBL21020132

SCHEMBL21020132

Cc1cc(-c2cc(F)c(=O)n(Cc3ccc4c(c3)OCO4)c2)nc(S(=O)(=O)CCC(OCc2ccccc2F)c2ccc3ncccc3c2)n1

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 2/20 0.34
▸ USP2 O75604 1/20 0.34
▸ PKM P14618 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ TP53 P04637 2/20 0.32
▸ ALDH1A1 P00352 7/20 0.31
▸ KMT2A Q03164 3/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ MET P08581 2/20 0.31
▸ HPGD P15428 1/20 0.31
▸ PDE5A O76074 1/20 0.31
▸ POLB P06746 2/20 0.31
▸ EGFR P00533 1/20 0.31
▸ LMNA P02545 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ GNRHR P30968 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
SCHEMBL21019764 0.91 ALDH1A1 (0.32) NPSR1USP2TP53ALDH1A1KMT2A
SCHEMBL19806107 0.90 GNRHR (0.36) USP2TP53ALDH1A1KMT2AMAPT
SCHEMBL30526076 0.90 GNRHR (0.36) USP2TP53ALDH1A1KMT2AMAPT
SCHEMBL21019917 0.90 GNRHR (0.34) USP2TP53ALDH1A1KMT2AMAPT
SCHEMBL21019765 0.90 PFKFB3 (0.32) TP53ALDH1A1KMT2AMAPTHTT
SCHEMBL21019766 0.90 ALDH1A1 (0.33) NPSR1TP53ALDH1A1KMT2AMAPT
SCHEMBL21020131 0.89 TP53 (0.33) USP2MAPK1TP53ALDH1A1KMT2A
SCHEMBL21019769 0.89 ALDH1A1 (0.34) USP2PKMMAPK1TP53ALDH1A1
SCHEMBL21020137 0.88 TP53 (0.32) USP2TP53ALDH1A1KMT2AMAPT
SCHEMBL19806023 0.87 GNRHR (0.36) USP2MAPK1TP53ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11725000-B2 Apoptosis inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2023-08-15 — — US disclosed
US-11725000-B2 Apoptosis inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2023-08-15 — — US disclosed
US-20210309647-A1 Apoptosis Inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2021-10-07 — — US disclosed
US-11034680-B2 Apoptosis inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2021-06-15 — — US disclosed
US-20190152960-A1 Apoptosis Inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2019-05-23 — — 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 (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-20190152960-A1 Apoptosis Inhibitors BAX, SDHA, SDHB NPSR1 4745/4885USP2 972/4885PKM 716/4885
US-11725000-B2 Apoptosis inhibitors BAX, SDHA, SDHB NPSR1 4745/4885USP2 972/4885PKM 716/4885
US-11034680-B2 Apoptosis inhibitors BAX, SDHA, SDHB NPSR1 4745/4885USP2 972/4885PKM 716/4885
US-20210309647-A1 Apoptosis Inhibitors BAX, SDHA, SDHB NPSR1 4745/4885USP2 972/4885PKM 716/4885

“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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