SCHEMBL29976264

SCHEMBL29976264

CSc1nc(-c2ccc(=O)[nH]c2)cc(C(F)(F)F)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.43
▸ MEN1 O00255 3/20 0.43
▸ TP53 P04637 5/20 0.42
▸ L3MBTL1 Q9Y468 4/20 0.42
▸ SMN1; SMN2 Q16637 4/20 0.42
▸ ALDH1A1 P00352 5/20 0.41
▸ NPSR1 Q6W5P4 4/20 0.41
▸ MAPK1 P28482 4/20 0.41
▸ HPGD P15428 4/20 0.41
▸ HSD17B10 Q99714 3/20 0.41
▸ MAPT P10636 4/20 0.41
▸ DGAT1 O75907 1/20 0.39
▸ SOAT1 P35610 1/20 0.39
▸ KCNH2 Q12809 1/20 0.39
▸ LMNA P02545 3/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ SDHB P21912 1/20 0.39
▸ PTGS2 P35354 1/20 0.39
▸ MITF O75030 1/20 0.39

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
SCHEMBL19805760 1.00 KMT2A (0.43) KMT2AMEN1TP53L3MBTL1SMN1; SMN2
SCHEMBL21019931 0.82 ALDH1A1 (0.40) KMT2AMEN1TP53L3MBTL1ALDH1A1
SCHEMBL20985663 0.80 MEN1 (0.43) KMT2AMEN1TP53L3MBTL1SMN1; SMN2
SCHEMBL21019879 0.80 PDK1 (0.39) KMT2AMEN1L3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL20985700 0.79 ALDH1A1 (0.39) KMT2AMEN1TP53L3MBTL1SMN1; SMN2
SCHEMBL19805847 0.78 SDHB (0.66) KMT2AMEN1TP53SMN1; SMN2ALDH1A1
SCHEMBL19805930 0.77 SDHB (0.57) KMT2AMEN1TP53L3MBTL1SMN1; SMN2
SCHEMBL19806054 0.77 KDM4E (0.60) KMT2AMEN1TP53L3MBTL1SMN1; SMN2
SCHEMBL4718764 0.77 MEN1 (0.49) KMT2AMEN1TP53L3MBTL1SMN1; SMN2
SCHEMBL20985669 0.76 KDM4E (0.61) KMT2AMEN1TP53L3MBTL1SMN1; SMN2

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 2 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
CN-110023292-B Apoptosis inhibitors 北京生命科学研究所 2022-10-04 — — CN 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 (1 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-11725000-B2 Apoptosis inhibitors BAX, SDHA, SDHB KMT2A 3060/4885MEN1 4080/4885TP53 160/4885

“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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