SCHEMBL22732600

SCHEMBL22732600

CN(C)CC(=O)N1CCCC(CN)C1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK3 P52333 3/20 0.42
▸ JAK2 O60674 3/20 0.42
▸ JAK1 P23458 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ ITGB3 P05106 3/20 0.40
▸ ITGA2B P08514 3/20 0.40
▸ MEN1 O00255 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ PREP P48147 1/20 0.37
▸ KDM1A O60341 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ CTSD P07339 2/20 0.36
▸ BACE1 P56817 2/20 0.36
▸ PAX8 Q06710 1/20 0.35
▸ F10 P00742 1/20 0.35
▸ KIT P10721 1/20 0.35
▸ FLT3 P36888 1/20 0.35

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
SCHEMBL21430657 1.00 JAK3 (0.42) JAK3JAK2JAK1ALDH1A1LMNA
SCHEMBL21430432 1.00 JAK3 (0.42) JAK3JAK2JAK1ALDH1A1LMNA
SCHEMBL13783473 0.86 MEN1 (0.42) JAK3JAK2JAK1ALDH1A1LMNA
SCHEMBL22732723 0.86 MEN1 (0.42) JAK3JAK2JAK1ALDH1A1LMNA
SCHEMBL3399184 0.82 MEN1 (0.44) ALDH1A1LMNAITGB3ITGA2BMEN1
SCHEMBL21430433 0.82 ITGB3 (0.41) JAK3JAK2JAK1ALDH1A1LMNA
SCHEMBL15808629 0.82 KDM1A (0.45) ALDH1A1LMNAITGB3ITGA2BMEN1
SCHEMBL15808534 0.81 KDM1A (0.45) JAK3JAK2JAK1ALDH1A1LMNA
SCHEMBL15808519 0.81 KDM1A (0.45) JAK3JAK2JAK1ALDH1A1LMNA
SCHEMBL23710028 0.81 ITGB3 (0.43) JAK3JAK2JAK1ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220220110-A1 METHYL- AND TRIFLUOROMETHYL-CONTAINING DISUBSTITUTED SULFONAMIDE SELECTIVE BCL-2 INHIBITOR CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2022-07-14 — — US disclosed
US-20220002290-A1 TRIFLUOROMETHYL-SUBSTITUTED SULFONAMIDE AS BCL-2-SELECTIVE INHIBITOR CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2022-01-06 — — US disclosed
EP-3858832-A1 TRIFLUOROMETHYL-SUBSTITUTED SULFONAMIDE AS BCL-2-SELECTIVE INHIBITOR Chia Tai Tianqing Pharmaceutical Group Co., Ltd. (CN) 2021-08-04 — — EP disclosed
WO-2020238785-A1 METHYL- AND TRIFLUOROMETHYL-CONTAINING DISUBSTITUTED SULFONAMIDE SELECTIVE BCL-2 INHIBITOR 正大天晴药业集团股份有限公司 2020-12-03 — — 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 (2 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-20220002290-A1 TRIFLUOROMETHYL-SUBSTITUTED SULFONAMIDE AS BCL-2-SELECTIVE INHIBITOR BCL2L11, BCL2, BCL2L2 JAK3 3242/4885JAK2 334/4885JAK1 1706/4885
US-20220220110-A1 METHYL- AND TRIFLUOROMETHYL-CONTAINING DISUBSTITUTED SULFONAMIDE SELECTIVE BCL-2 INHIBITOR BCL2L11, BCL2, BCL2L1 JAK3 3428/4885JAK2 544/4885JAK1 1973/4885

“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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