SCHEMBL24067323

SCHEMBL24067323

CC(=O)c1cn(C[C@@H]2CCCN2C(=O)CC2CCCCC2)c2ccc(Cl)c(F)c12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IL1B P01584 7/20 0.41
▸ P2RX7 Q99572 6/20 0.41
▸ CNR1 P21554 3/20 0.40
▸ CFD P00746 2/20 0.39
▸ OPRK1 P41145 5/20 0.39
▸ NPC1 O15118 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ CYP2D6 P10635 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ NFKB1 P19838 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ OPRD1 P41143 1/20 0.37
▸ HIF1A Q16665 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ BLM P54132 1/20 0.37
▸ PMP22 Q01453 1/20 0.37
▸ DRD4 P21917 1/20 0.37
▸ SLC6A3 Q01959 1/20 0.37
▸ TMEM97 Q5BJF2 1/20 0.37

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
SCHEMBL24067316 0.87 IL1B (0.50) IL1BP2RX7CNR1
SCHEMBL22450928 0.82 CNR1 (0.56) CNR1CFDOPRK1
SCHEMBL24067361 0.81 CNR1 (0.42) CNR1OPRK1NPC1CYP1A2CYP3A4
SCHEMBL22450676 0.80 CNR1 (0.55) CNR1UTS2R
SCHEMBL24067341 0.79 TNF (0.44) IL1BP2RX7CYP3A4
SCHEMBL24067324 0.79 TNF (0.44) IL1BP2RX7CYP3A4
SCHEMBL24067458 0.78 CNR1 (0.47) CNR1
SCHEMBL24067319 0.71 CNR1 (0.47) CNR1OPRK1NPC1UTS2R
SCHEMBL22450890 0.71 IL1B (0.33) IL1BP2RX7CNR1OPRK1
SCHEMBL24067339 0.70 CFD (0.41) CNR1CFD

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-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-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 (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-20210371400-A1 SMAC MIMETICS USED AS IAP INHIBITORS AND USE THEREOF BIRC7, BIRC5, BIRC2 IL1B 1650/4885P2RX7 3661/4885CNR1 4859/4885
US-11358950-B2 SMAC mimetics used as IAP inhibitors and use thereof BIRC7, BIRC5, BIRC2 IL1B 1650/4885P2RX7 3661/4885CNR1 4859/4885

“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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