SCHEMBL24938702

SCHEMBL24938702

CC(=O)OCc1cnn(-c2ccc(F)cc2)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.43
P2RX7 Q99572 1/20 0.41
NPC1 O15118 4/20 0.38
RAB9A P51151 4/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
GABRA2 P47869 1/20 0.37
GABRB2 P47870 1/20 0.37
L3MBTL1 Q9Y468 3/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
HDAC3 O15379 1/20 0.36
NCOR1 O75376 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
ADAMTS7 Q9UKP4 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MIF P14174 1/20 0.34
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL23367526 0.73 ADAMTS7 (0.44) PTGS2NPC1RAB9AL3MBTL1MEN1
SCHEMBL23354760 0.72 GABRA2 (0.54) NPC1RAB9ALMNAPOLBGABRA2
SCHEMBL9209960 0.69 AOC3 (0.64) PTGS2CHRNA7
SCHEMBL9201624 0.69 PTGS2 (0.47) PTGS2MEN1KMT2ACHRNA7
SCHEMBL752920 0.69 MAOB (0.42) LMNAL3MBTL1ALDH1A1KDM4ECASP3
SCHEMBL29874448 0.69 GABRA2 (0.50) NPC1RAB9ALMNAPOLBGABRA2
SCHEMBL5360275 0.68 ALDH1A1 (0.64) NPC1RAB9ALMNAL3MBTL1MEN1
SCHEMBL29254887 0.68 MIF (0.42) P2RX7NPC1RAB9AL3MBTL1MEN1
SCHEMBL13754587 0.67 ALDH1A1 (0.58) NPC1RAB9ALMNAL3MBTL1MEN1
SCHEMBL17334297 0.67 GRM5 (0.71)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230027985-A1 SUBSTITUTED HYDANTOINAMIDES AS ADAMTS7 ANTAGONISTS BAYER AKTIENGESELLSCHAFT (DE) 2023-01-26 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 (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-20230027985-A1 SUBSTITUTED HYDANTOINAMIDES AS ADAMTS7 ANTAGONISTS ADAMTS7, MMP7, ADAMTS1 PTGS2 1855/4885P2RX7 604/4885NPC1 3408/4885

“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.