SCHEMBL24938196

SCHEMBL24938196

CCc1cc(CC(C)=N)cc(OC)c1OC

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.50
ALDH1A1 P00352 2/20 0.40
GAA P10253 1/20 0.40
KDM4E B2RXH2 1/20 0.40
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
HTR2B P41595 1/20 0.39
KMT2A Q03164 4/20 0.38
MAPK1 P28482 1/20 0.38
CYP3A4 P08684 1/20 0.38
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL11553231 0.75 ALDH1A1 (0.53) PTGS2ALDH1A1CYP3A4SMN1; SMN2
SCHEMBL21740733 0.73 PTGS2 (0.53) PTGS2HTR2AHTR2CHTR2B
SCHEMBL8230395 0.73 PTGS2 (0.68) PTGS2HTR2AHTR2CHTR2BCYP3A4
SCHEMBL2307800 0.72 PTGS2 (0.55) PTGS2ALDH1A1GAAKDM4EHTR2A
SCHEMBL6845422 0.71 PTGS2 (0.59) PTGS2KDM4EHTR2AHTR2CHTR2B
SCHEMBL20179601 0.71 TUBB4A (0.58) PTGS2KDM4EKMT2ACYP3A4SMN1; SMN2
SCHEMBL4240508 0.70 PTGS2 (0.53) PTGS2ALDH1A1GAAKDM4EHTR2A
SCHEMBL21102118 0.70 CA2 (0.59) ALDH1A1GAAKDM4EKMT2AMAPK1
SCHEMBL4683243 0.70 KDM4E (0.55) PTGS2ALDH1A1GAAKDM4EHTR2A
SCHEMBL21101917 0.70 KDM4E (0.55) ALDH1A1GAAKDM4EKMT2AMAPK1

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
EP-4119552-A1 REGULATING CHIMERIC ANTIGEN RECEPTORS Dana-Farber Cancer Institute, Inc. (US) 2023-01-18 EP disclosed