SCHEMBL21019774

SCHEMBL21019774

Cc1cc(-c2cc(F)c(=O)n(Cc3ccc4c(c3)OCO4)c2)nc(S(=O)(=O)CCC(OCc2ccco2)c2ccccc2)n1

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ GNRHR P30968 2/20 0.34
▸ TSHR P16473 2/20 0.33
▸ HSD17B10 Q99714 2/20 0.33
▸ TP53 P04637 2/20 0.33
▸ ALDH1A1 P00352 8/20 0.33
▸ PDE5A O76074 1/20 0.32
▸ MAPK10 P53779 1/20 0.32
▸ HIF1A Q16665 1/20 0.32
▸ BMP1 P13497 1/20 0.32
▸ EGFR P00533 2/20 0.31
▸ PKM P14618 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ USP2 O75604 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ SDHB P21912 1/20 0.31

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
SCHEMBL30526076 0.92 GNRHR (0.36) GNRHRHSD17B10TP53ALDH1A1PDE5A
SCHEMBL19806107 0.92 GNRHR (0.36) GNRHRHSD17B10TP53ALDH1A1PDE5A
SCHEMBL21019776 0.91 GNRHR (0.34) GNRHRHSD17B10TP53ALDH1A1PDE5A
SCHEMBL21019479 0.90 TP53 (0.34) GNRHRHSD17B10TP53ALDH1A1PDE5A
SCHEMBL30526107 0.90 TP53 (0.35) GNRHRHSD17B10TP53ALDH1A1PDE5A
SCHEMBL19805942 0.90 TP53 (0.35) GNRHRHSD17B10TP53ALDH1A1PDE5A
SCHEMBL21020135 0.89 ALDH1A1 (0.33) GNRHRHSD17B10TP53ALDH1A1PDE5A
SCHEMBL19805644 0.89 TP53 (0.35) GNRHRHSD17B10TP53ALDH1A1PDE5A
SCHEMBL21019924 0.89 ALDH1A1 (0.33) GNRHRHSD17B10TP53ALDH1A1PDE5A
SCHEMBL19806023 0.88 GNRHR (0.36) GNRHRTSHRHSD17B10TP53ALDH1A1

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 GNRHR 3014/4885TSHR 4738/4885HSD17B10 110/4885
US-11725000-B2 Apoptosis inhibitors BAX, SDHA, SDHB GNRHR 3014/4885TSHR 4738/4885HSD17B10 110/4885
US-11034680-B2 Apoptosis inhibitors BAX, SDHA, SDHB GNRHR 3014/4885TSHR 4738/4885HSD17B10 110/4885
US-20210309647-A1 Apoptosis Inhibitors BAX, SDHA, SDHB GNRHR 3014/4885TSHR 4738/4885HSD17B10 110/4885

“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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