SCHEMBL29904384

SCHEMBL29904384

CCOc1cc(C(C)N)cc(OC)c1OC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.45
DHFR P00374 1/20 0.45
PTGS2 P35354 1/20 0.44
HTR2A P28223 2/20 0.44
HTR2C P28335 2/20 0.44
HTR2B P41595 2/20 0.44
TUBB4A P04350 1/20 0.43
TUBB P07437 1/20 0.43
TUBA3C P0DPH7 1/20 0.43
TUBA1B P68363 1/20 0.43
TUBA4A P68366 1/20 0.43
TUBB4B P68371 1/20 0.43
TUBB3 Q13509 1/20 0.43
TUBB2A Q13885 1/20 0.43
TUBB8 Q3ZCM7 1/20 0.43
TUBA3E Q6PEY2 1/20 0.43
TUBA1A Q71U36 1/20 0.43
TUBA1C Q9BQE3 1/20 0.43
TUBB6 Q9BUF5 1/20 0.43
TUBB2B Q9BVA1 1/20 0.43

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
SCHEMBL1134650 0.87 ACHE (0.50) L3MBTL1PTGS2HTR2AHTR2CHTR2B
SCHEMBL8751285 0.87 ACHE (0.50) L3MBTL1PTGS2HTR2AHTR2CHTR2B
Hydrochloric Acid SCHEMBL30806023 0.85 ACHE (0.48) L3MBTL1PTGS2HTR2AHTR2CHTR2B
Hydrochloric Acid SCHEMBL13269232 0.85 ACHE (0.48) L3MBTL1PTGS2HTR2AHTR2CHTR2B
SCHEMBL15870719 0.79 ALDH1A1 (0.53) L3MBTL1MAPK1MAPTKDM4EGAA
SCHEMBL1223581 0.79 ALDH1A1 (0.53) L3MBTL1MAPK1MAPTKDM4EGAA
SCHEMBL30769620 0.79 SMN1; SMN2 (0.46) L3MBTL1HTR2AHTR2CHTR2BTUBB4A
SCHEMBL11491615 0.79 GAA (0.57) MAPK1MAPTKDM4EGAA
SCHEMBL30302240 0.79 MEN1 (0.49) MAPK1MAPT
SCHEMBL24489022 0.78 ALDH1A1 (0.37) L3MBTL1MAPK1MAPTKDM4EGAA

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
EP-4313030-A1 METHODS AND COMPOSITIONS RELATING TO PSYCHEDELICS AND SEROTONIN RECEPTOR MODULATORS Terran Biosciences, Inc. (US) 2024-02-07 EP claimed
WO-2022212854-A1 METHODS AND COMPOSITIONS RELATING TO PSYCHEDELICS AND SEROTONIN RECEPTOR MODULATORS TERRAN BIOSCIENCES INC. (US) 2022-10-06 WO claimed
EP-4547250-A1 METHODS AND COMPOSITIONS RELATING TO CONTROLLING PSYCHEDELIC EFFECTS WITH SEROTONIN RECEPTOR MODULATORS Terran Biosciences Inc. (US) 2025-05-07 EP disclosed
WO-2024006984-A1 METHODS AND COMPOSITIONS RELATING TO CONTROLLING PSYCHEDELIC EFFECTS WITH SEROTONIN RECEPTOR MODULATORS TERRAN BIOSCIENCES INC. (US) 2024-01-04 WO disclosed