SCHEMBL31545329

SCHEMBL31545329

CC1(C)CCc2c(O)cc(C3CCCCCCC3)cc2O1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 1/20 0.38
▸ MAOB P27338 1/20 0.38
▸ OSBP P22059 8/20 0.38
▸ CNR2 P34972 2/20 0.36
▸ CYP19A1 P11511 1/20 0.35
▸ CTSB P07858 1/20 0.35
▸ CTSD P07339 1/20 0.35
▸ BACE1 P56817 1/20 0.35
▸ PDE5A O76074 1/20 0.34
▸ PTPN1 P18031 3/20 0.33
▸ PDE4D Q08499 1/20 0.33

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
SCHEMBL24212555 1.00 MAOA (0.38) MAOAMAOBOSBPCNR2CYP19A1
SCHEMBL31545960 0.76 ALDH1A1 (0.49) MAOAMAOBOSBPCYP19A1CTSB
SCHEMBL3246245 0.76 ALDH1A1 (0.49) MAOAMAOBOSBPCYP19A1CTSB
SCHEMBL31545958 0.73 CYP19A1 (0.39) OSBPCYP19A1CTSBPDE5APDE4D
SCHEMBL24212287 0.73 CYP19A1 (0.39) OSBPCYP19A1CTSBPDE5APDE4D
SCHEMBL11846089 0.72 OPRM1 (0.39) MAOAMAOBCTSBBACE1PTPN1
SCHEMBL31545318 0.71 MAOA (0.41) MAOAMAOBOSBPCYP19A1CTSB
SCHEMBL11444801 0.71 PDE5A (0.49) MAOAMAOBOSBPCYP19A1CTSB
SCHEMBL17027071 0.71 MAOA (0.41) MAOAMAOBOSBPCYP19A1CTSB
SCHEMBL11843833 0.70 OPRM1 (0.39) MAOAMAOBOSBPCTSBPTPN1

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-20250090554-A1 A METHOD OF TREATING DEPRESSION BY IMMUNE MODULATION MYND LIFE SCIENCES INC (CA) 2025-03-20 — — US disclosed
Send feedback