SCHEMBL25090352

SCHEMBL25090352

CC(C)(C)OC(=O)N1CCCC(CCc2cccc(C(F)(F)F)c2)(C(=O)O)C1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 4/20 0.47
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
CYP1A2 P05177 2/20 0.42
CYP3A4 P08684 2/20 0.42
CYP2D6 P10635 2/20 0.42
TSHR P16473 2/20 0.42
EPHX2 P34913 1/20 0.42
MAPT P10636 1/20 0.40
USP30 Q70CQ3 3/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
LIPG Q9Y5X9 1/20 0.39
S1PR1 P21453 1/20 0.38
GRK5 P34947 1/20 0.38
CDK8 P49336 1/20 0.38
S1PR5 Q9H228 1/20 0.38
RORC P51449 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
KCNH2 Q12809 1/20 0.38
USP2 O75604 1/20 0.38

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
SCHEMBL30201405 1.00 TACR1 (0.47) TACR1MEN1KMT2ACYP1A2CYP3A4
SCHEMBL29328059 0.93 TACR1 (0.45) TACR1MEN1KMT2ACYP1A2CYP3A4
SCHEMBL25090456 0.89 L3MBTL1 (0.51) TACR1MEN1KMT2AMAPTL3MBTL1
SCHEMBL30201121 0.86 MEN1 (0.46) TACR1MEN1KMT2ACYP1A2CYP3A4
SCHEMBL25090446 0.86 MEN1 (0.46) TACR1MEN1KMT2ACYP1A2CYP3A4
SCHEMBL25090079 0.85 TACR1 (0.45) TACR1MEN1KMT2ACYP1A2CYP3A4
SCHEMBL30201079 0.85 TACR1 (0.45) TACR1MEN1KMT2ACYP1A2CYP3A4
SCHEMBL25090353 0.84 TACR1 (0.44) TACR1MEN1KMT2ACYP1A2CYP3A4
SCHEMBL25090264 0.84 TACR1 (0.44) TACR1MEN1KMT2ACYP1A2CYP3A4
SCHEMBL30201152 0.84 TACR1 (0.44) TACR1MEN1KMT2ACYP1A2CYP3A4

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-20240239766-A1 3-AMINO PIPERIDYL SODIUM CHANNEL INHIBITORS GENENTECH, INC. (US) 2024-07-18 US disclosed
US-20240239766-A1 3-AMINO PIPERIDYL SODIUM CHANNEL INHIBITORS GENENTECH, INC. (US) 2024-07-18 US disclosed
WO-2023028056-A1 3-AMINO PIPERIDYL SODIUM CHANNEL INHIBITORS GENENTECH, INC. (US) 2023-03-02 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-20240239766-A1 3-AMINO PIPERIDYL SODIUM CHANNEL INHIBITORS CACNA1E, TRPV1, SCN3A TACR1 174/4885MEN1 2615/4885KMT2A 882/4885

“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.