SCHEMBL8438434

SCHEMBL8438434

c1ccc(C(c2ccccc2)N2CC(n3ccnc3)C2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 7/20 0.51
FAAH O00519 1/20 0.47
MGLL Q99685 1/20 0.47
CYP17A1 P05093 2/20 0.45
MEN1 O00255 2/20 0.45
HTR2A P28223 2/20 0.45
KMT2A Q03164 2/20 0.45
KCNH2 Q12809 2/20 0.45
NR1I2 O75469 1/20 0.45
USP2 O75604 1/20 0.45
ABCB11 O95342 1/20 0.45
ALDH1A1 P00352 1/20 0.45
PLA2G1B P04054 1/20 0.45
TP53 P04637 1/20 0.45
PGR P06401 1/20 0.45
HSP90AA1 P07900 1/20 0.45
CYP3A4 P08684 1/20 0.45
MAPT P10636 1/20 0.45
IDO1 P14902 1/20 0.45
HPGD P15428 1/20 0.45

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
SCHEMBL9808539 0.75 CYP19A1 (0.44) CYP19A1FAAHMGLLCYP17A1MEN1
SCHEMBL4956153 0.73 CYP19A1 (0.42) CYP19A1FAAHMGLLMEN1HTR2A
SCHEMBL9293015 0.72 CYP19A1 (0.51) CYP19A1FAAHMGLLMEN1HTR2A
SCHEMBL9293306 0.72 CYP19A1 (0.51) CYP19A1FAAHMGLLMEN1HTR2A
Hydrochloric Acid SCHEMBL28169692 0.71 CYP19A1 (0.96) CYP19A1CYP17A1MEN1HTR2AKMT2A
SCHEMBL13457938 0.69 CYP19A1 (0.49) CYP19A1CYP17A1KCNH2CYP3A4IDO1
SCHEMBL6980526 0.69 CYP2D6 (0.43) CYP19A1FAAHMGLLMEN1HTR2A
SCHEMBL738495 0.69 CYP19A1 (1.00) CYP19A1CYP17A1MEN1HTR2AKMT2A
Hydrochloric Acid SCHEMBL10506432 0.69 OPRM1 (0.47) MEN1HTR2AKMT2AKCNH2USP2
Hydrochloric Acid SCHEMBL10401309 0.69 OPRM1 (0.47) MEN1HTR2AKMT2AKCNH2USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3604305-B1 NOVEL PYRIDONE CARBOXYLIC ACID DERIVATIVE OR SALT THEREOF WAKUNAGA PHARMA CO LTD (JP) 2024-08-28 EP disclosed
CN-110520422-B Novel pyridonecarboxylic acid derivative or salt thereof 涌永制药株式会社 2023-09-05 CN disclosed
US-11286255-B2 Pyridone carboxylic acid derivative or salt thereof WAKUNAGA PHARMACEUTICAL CO., LTD. (JP) 2022-03-29 US disclosed
US-20200062752-A1 NOVEL PYRIDONE CARBOXYLIC ACID DERIVATIVE OR SALT THEREOF WAKUNAGA PHARMACEUTICAL CO., LTD. (JP) 2020-02-27 US disclosed
EP-3604305-A1 NOVEL PYRIDONE CARBOXYLIC ACID DERIVATIVE OR SALT THEREOF Wakunaga Pharmaceutical Co., Ltd. (JP) 2020-02-05 EP disclosed
US-5866564-A STABILITY SANKYO COMPANY, LIMITED (JP) 1999-02-02 US disclosed
CN-1037180-C Antimicrobial carbapenem derivatives, their preparation and their therapeutic use SANKYO CO (JP) 1998-01-28 CN disclosed
US-5712267-A Carbapenem derivatives, their preparation and their use as antibiotics SANKYO COMPANY,. LIMITED (JP) 1998-01-27 US disclosed
CN-1079472-A Antimicrobial carbapeneme derivatives, their preparation and their application in treatment SANKYO CO (JP) 1993-12-15 CN disclosed
EP-0560613-A1 Antimicrobial carbapenem derivatives, their preparation and their therapeutic use SANKYO COMPANY LIMITED (JP) 1993-09-15 EP 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-20200062752-A1 NOVEL PYRIDONE CARBOXYLIC ACID DERIVATIVE OR SALT THEREOF RAB10, HDAC10, NEK10 CYP19A1 3319/4885FAAH 3852/4885MGLL 3476/4885
US-11286255-B2 Pyridone carboxylic acid derivative or salt thereof RARA, RAB10, RABL6 CYP19A1 2635/4885FAAH 3980/4885MGLL 3383/4885

“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.