SCHEMBL22817596

SCHEMBL22817596

CN(Cc1ccccc1)C[C@H](O)c1cccc(C(F)(F)F)c1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.58
PNMT P11086 1/20 0.54
KDM4E B2RXH2 2/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
ALDH1A1 P00352 1/20 0.50
CETP P11597 2/20 0.49
TAAR1 Q96RJ0 1/20 0.48
ACP3 P15309 1/20 0.48
GRIN2B Q13224 2/20 0.47
TRPM8 Q7Z2W7 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
SCHEMBL22817597 1.00 CNR2 (0.58) CNR2PNMTKDM4EMEN1KMT2A
SCHEMBL30034816 1.00 CNR2 (0.58) CNR2PNMTKDM4EMEN1KMT2A
SCHEMBL30353293 1.00 CNR2 (0.58) CNR2PNMTKDM4EMEN1KMT2A
SCHEMBL22817603 1.00 CNR2 (0.58) CNR2PNMTKDM4EMEN1KMT2A
SCHEMBL22817612 0.84 KDM4E (0.47) CNR2PNMTKDM4EMEN1KMT2A
SCHEMBL30034139 0.84 KDM4E (0.47) CNR2PNMTKDM4EMEN1KMT2A
SCHEMBL22817610 0.84 KDM4E (0.47) CNR2PNMTKDM4EMEN1KMT2A
SCHEMBL28168728 0.82 MEN1 (0.54) CNR2KDM4EMEN1KMT2ASMN1; SMN2
SCHEMBL25304558 0.82 PNMT (0.64) PNMTCETPACP3GRIN2B
SCHEMBL13993320 0.81 KDM4E (0.70) CNR2KDM4EMEN1KMT2ASMN1; SMN2

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-11560367-B2 Pyrrolidinones and a process to prepare them FMC CORPORATION (US) 2023-01-24 US disclosed
US-20210107890-A1 PYRROLIDINONES AND A PROCESS TO PREPARE THEM FMC CORPORATION 2021-04-15 US disclosed
US-10875838-B2 Pyrrolidinones and a process to prepare them FMC CORPORATION (US) 2020-12-29 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 (3 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-10875838-B2 Pyrrolidinones and a process to prepare them CCNB1, CCNA2, F2 CNR2 1503/4885PNMT 709/4885KDM4E 1079/4885
US-20210107890-A1 PYRROLIDINONES AND A PROCESS TO PREPARE THEM CCNB1, CCNA2, F2 CNR2 1503/4885PNMT 709/4885KDM4E 1079/4885
US-11560367-B2 Pyrrolidinones and a process to prepare them CCNB1, CCNA2, F2 CNR2 1503/4885PNMT 709/4885KDM4E 1079/4885

“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.