SCHEMBL23389221

SCHEMBL23389221

CN(C)c1ccc(C(=O)O)c(F)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 3/20 0.49
RXRB P28702 2/20 0.49
RXRG P48443 2/20 0.49
SLC16A3 O15427 1/20 0.47
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 1/20 0.44
PLG P00747 1/20 0.42
PLAU P00749 1/20 0.42
PLAT P00750 1/20 0.42
RARB P10826 2/20 0.42
RARA P10276 1/20 0.42
RARG P13631 1/20 0.42
MYC P01106 1/20 0.41
HPGD P15428 3/20 0.41
MAPT P10636 2/20 0.41
NPC1 O15118 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
POLB P06746 1/20 0.41
MAOA P21397 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
SCHEMBL31371666 0.85 SLC16A3 (0.47) SLC16A3ALDH1A1KDM4EMYCHPGD
SCHEMBL19454401 0.83 KMT2A (0.42) RXRARXRBRXRGSLC16A3ALDH1A1
SCHEMBL24849607 0.82 KMT2A (0.59) RXRARXRBRXRGALDH1A1KDM4E
SCHEMBL8646935 0.82 SLC16A3 (0.51) SLC16A3ALDH1A1KDM4EMYCHPGD
SCHEMBL7688037 0.81 RXRA (0.44) RXRARXRBRXRGALDH1A1MAPT
SCHEMBL1110796 0.80 CA12 (0.43) ALDH1A1KDM4EHPGDMAPTNPC1
SCHEMBL10606874 0.80 SLC16A3 (0.50) SLC16A3ALDH1A1KDM4EMYCHPGD
SCHEMBL2434816 0.80 RXRA (0.43) RXRARXRBRXRGALDH1A1KDM4E
SCHEMBL25217340 0.79 KLKB1 (0.45) ALDH1A1KDM4EMAPTNPC1MEN1
SCHEMBL352720 0.78 SLC16A3 (0.49) RXRARXRBSLC16A3ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230026271-A1 Piperazine Compounds for Inhibiting CPS1 EISAI R&D MANAGEMENT CO., LTD. (JP) 2023-01-26 US disclosed
EP-4061803-A1 PIPERAZINE COMPOUNDS FOR INHIBITING CPS1 Eisai R&D Management Co., Ltd. (JP) 2022-09-28 EP disclosed
CN-114981247-A Piperazine compounds for inhibiting CPS1 卫材R&D管理有限公司 2022-08-30 CN disclosed
WO-2021102300-A1 PIPERAZINE COMPOUNDS FOR INHIBITING CPS1 EISAI R&D MANAGEMENT CO., LTD. (JP) 2021-05-27 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 (1 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-20230026271-A1 Piperazine Compounds for Inhibiting CPS1 CPS1, CPSF1, CPSF7 RXRA 3267/4885RXRB 3139/4885RXRG 3208/4885

“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.