SCHEMBL21580071

SCHEMBL21580071

Cn1cccc(C(=O)NCc2cccc(OCc3ccccc3F)c2)c1=O

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LIPG Q9Y5X9 2/20 0.47
▸ KDM4E B2RXH2 2/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ HPGD P15428 2/20 0.45
▸ USP2 O75604 1/20 0.45
▸ TP53 P04637 2/20 0.44
▸ THRB P10828 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ MAPT P10636 1/20 0.43
▸ APEX1 P27695 1/20 0.42
▸ LMNA P02545 2/20 0.42
▸ PARP15 Q460N3 1/20 0.41
▸ PARP10 Q53GL7 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ PDPK1 O15530 1/20 0.41

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
SCHEMBL21580164 0.89 SCN3A (0.52) LIPGKDM4EALDH1A1HPGDTP53
SCHEMBL21580146 0.88 PARP15 (0.45) LIPGALDH1A1HPGDTP53MAPT
SCHEMBL23691880 0.83 MMP13 (0.47) KDM4EALDH1A1HPGDTP53THRB
SCHEMBL23691868 0.81 HPGD (0.42) KDM4EALDH1A1HPGDUSP2TP53
SCHEMBL21580038 0.80 KDM4E (0.41) KDM4EALDH1A1HPGDUSP2TP53
SCHEMBL21580033 0.80 KDM4E (0.41) KDM4EALDH1A1HPGDUSP2TP53
SCHEMBL21580057 0.80 TP53 (0.42) KDM4EALDH1A1HPGDUSP2TP53
SCHEMBL21580066 0.80 TP53 (0.47) KDM4EALDH1A1HPGDUSP2TP53
SCHEMBL923356 0.78 KMT2A (0.49) KDM4EALDH1A1HPGDUSP2RAB9A
SCHEMBL21580055 0.76 KDM4E (0.48) KDM4EALDH1A1TP53THRBRAB9A

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-11384085-B2 Modulators of ion channel receptors and uses thereof BIONOMICS LIMITED (AU) 2022-07-12 — — US disclosed
US-20210230165-A1 MODULATORS OF ION CHANNEL RECEPTORS AND USES THEREOF BIONOMICS LIMITED (AU) 2021-07-29 — — US disclosed
WO-2019218025-A1 MODULATORS OF ION CHANNEL RECEPTORS AND USES THEREOF BIONOMICS LIMITED (AU) 2019-11-21 — — 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-20210230165-A1 MODULATORS OF ION CHANNEL RECEPTORS AND USES THEREOF TRPV1, TRPM8, TRPV2 LIPG 2464/4885KDM4E 4014/4885ALDH1A1 3010/4885
US-11384085-B2 Modulators of ion channel receptors and uses thereof TRPV1, TRPM8, TRPV2 LIPG 2464/4885KDM4E 4014/4885ALDH1A1 3010/4885

“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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