SCHEMBL23091199

SCHEMBL23091199

CC(C)NC(=O)c1ccc(-c2cc(F)cc(F)c2)o1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.61
CYP2C19 P33261 1/20 0.61
KDM4E B2RXH2 3/20 0.58
SMN1; SMN2 Q16637 1/20 0.53
SLC9A1 P19634 1/20 0.52
NR4A1 P22736 1/20 0.46
NR4A2 P43354 1/20 0.46
NR4A3 Q92570 1/20 0.46
C3AR1 Q16581 1/20 0.44
PTPN1 P18031 1/20 0.44
ALDH1A1 P00352 3/20 0.43
LMNA P02545 2/20 0.43
HPGD P15428 1/20 0.43
MMP13 P45452 2/20 0.42
NPC1 O15118 1/20 0.42
SUCNR1 Q9BXA5 1/20 0.42
MGAM O43451 1/20 0.42
GAA P10253 1/20 0.42
SI P14410 1/20 0.42
MGAM2 Q2M2H8 1/20 0.42

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
SCHEMBL23222393 0.92 CYP1A2 (0.56) CYP1A2CYP2C19KDM4ESMN1; SMN2SLC9A1
SCHEMBL4945642 0.84 SLC9A1 (0.57) CYP1A2CYP2C19KDM4ESLC9A1NR4A1
SCHEMBL23091227 0.84 CYP1A2 (0.59) CYP1A2CYP2C19KDM4ESMN1; SMN2SLC9A1
SCHEMBL23222428 0.83 KDM4E (0.60) CYP1A2CYP2C19KDM4ESMN1; SMN2ALDH1A1
SCHEMBL23091158 0.83 KDM4E (0.62) CYP1A2CYP2C19KDM4ESMN1; SMN2C3AR1
SCHEMBL23091178 0.80 CYP1A2 (0.65) CYP1A2CYP2C19KDM4ESMN1; SMN2SLC9A1
SCHEMBL23091209 0.79 KDM4E (0.57) CYP1A2CYP2C19KDM4ESMN1; SMN2PTPN1
SCHEMBL23091202 0.79 MMP13 (0.60) CYP1A2CYP2C19KDM4ESMN1; SMN2ALDH1A1
SCHEMBL23091245 0.78 KDM4E (0.60) CYP1A2CYP2C19KDM4ESMN1; SMN2PTPN1
SCHEMBL23091271 0.78 KDM4E (0.56) CYP1A2CYP2C19KDM4ESMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3805210-B1 NOVEL COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AUTOPHAGYSCIENCES INC (KR) 2023-11-29 EP claimed
CN-112004807-B Compounds and pharmaceutical compositions comprising the same 自体吞噬科学有限公司 2023-07-18 CN claimed
US-11407744-B2 Compound and pharmaceutical composition comprising same Autophagysciences Inc. (KR) 2022-08-09 US claimed
EP-3805210-A1 NOVEL COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME Autophagysciences, Inc (KR) 2021-04-14 EP claimed
US-20210078987-A1 NOVEL COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME Autophagysciences Inc. (KR) 2021-03-18 US claimed
EP-3805210-B1 NOVEL COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AUTOPHAGYSCIENCES INC (KR) 2023-11-29 EP disclosed
CN-112004807-B Compounds and pharmaceutical compositions comprising the same 自体吞噬科学有限公司 2023-07-18 CN disclosed
US-11407744-B2 Compound and pharmaceutical composition comprising same Autophagysciences Inc. (KR) 2022-08-09 US disclosed
EP-3805210-A1 NOVEL COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME Autophagysciences, Inc (KR) 2021-04-14 EP disclosed
US-20210078987-A1 NOVEL COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME Autophagysciences Inc. (KR) 2021-03-18 US disclosed
US-20210078987-A1 NOVEL COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME Autophagysciences Inc. (KR) 2021-03-18 US disclosed
CN-112004807-A Novel compounds and pharmaceutical compositions comprising said compounds 自体吞噬科学有限公司 2020-11-27 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 (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-11407744-B2 Compound and pharmaceutical composition comprising same TFEB, ATG7, BECN1 CYP1A2 4347/4885CYP2C19 4643/4885KDM4E 3653/4885
US-20210078987-A1 NOVEL COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME TFEB, ATG7, BECN1 CYP1A2 4544/4885CYP2C19 4772/4885KDM4E 3445/4885

“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.