SCHEMBL24067322

SCHEMBL24067322

CC(C)C(=O)c1c[nH]c2ccc(Cl)cc12

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ F7 P08709 1/20 0.69
▸ F3 P13726 1/20 0.69
▸ NR4A2 P43354 1/20 0.64
▸ PYGL P06737 1/20 0.54
▸ HTR2A P28223 1/20 0.52
▸ ALDH1A1 P00352 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ NHERF1 O14745 4/20 0.51

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
SCHEMBL30457940 0.88 F7 (0.65) F7F3NR4A2PYGLALDH1A1
SCHEMBL9788942 0.88 F7 (0.65) F7F3NR4A2PYGLALDH1A1
SCHEMBL3188134 0.88 NR4A2 (0.64) F7F3NR4A2HTR2AALDH1A1
SCHEMBL26261524 0.85 NR4A2 (0.62) F7F3NR4A2PYGLNHERF1
SCHEMBL26261554 0.85 NR4A2 (0.62) F7F3NR4A2PYGLNHERF1
SCHEMBL30457844 0.85 NR4A2 (0.62) F7F3NR4A2PYGLNHERF1
SCHEMBL25259281 0.85 NR4A2 (0.62) F7F3NR4A2PYGLNHERF1
Hydrochloric Acid SCHEMBL25306279 0.84 NR4A2 (0.60) F7F3NR4A2PYGLNHERF1
SCHEMBL25742072 0.82 NR4A2 (0.58) F7F3NR4A2PYGLNHERF1
SCHEMBL5912617 0.82 F7 (0.75) F7F3NR4A2PYGLNHERF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11358950-B2 SMAC mimetics used as IAP inhibitors and use thereof CHIA TAI TIANGQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2022-06-14 — — US disclosed
US-20220175917-A1 COMBINATION OF IAP INHIBITOR AND IMMUNE CHECKPOINT INHIBITOR CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2022-06-09 — — US disclosed
US-20210371400-A1 SMAC MIMETICS USED AS IAP INHIBITORS AND USE THEREOF CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2021-12-02 — — 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 (3 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-20220175917-A1 COMBINATION OF IAP INHIBITOR AND IMMUNE CHECKPOINT INHIBITOR BIRC5, XIAP, BIRC2 F7 4383/4885F3 4159/4885NR4A2 3646/4885
US-20210371400-A1 SMAC MIMETICS USED AS IAP INHIBITORS AND USE THEREOF BIRC7, BIRC5, BIRC2 F7 4372/4885F3 3891/4885NR4A2 4003/4885
US-11358950-B2 SMAC mimetics used as IAP inhibitors and use thereof BIRC7, BIRC5, BIRC2 F7 4372/4885F3 3891/4885NR4A2 4003/4885

“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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