SCHEMBL31478904

SCHEMBL31478904

COc1cc(C(=O)N(C)[C@H](CN2CCC(OC)CC2)C(C)C)ccc1C

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.43
▸ MEN1 O00255 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ HSD11B1 P28845 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.37
▸ CYP2D6 P10635 1/20 0.37
▸ TAS1R3 Q7RTX0 1/20 0.37
▸ TAS1R1 Q7RTX1 1/20 0.37
▸ CFB P00751 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
SCHEMBL9104362 1.00 KMT2A (0.43) KMT2AMEN1POLBHSD11B1ALDH1A1
SCHEMBL9104352 1.00 KMT2A (0.43) KMT2AMEN1POLBHSD11B1ALDH1A1
SCHEMBL9105476 0.91 ALDH1A1 (0.37) ALDH1A1TAS1R3TAS1R1
SCHEMBL9105466 0.91 ALDH1A1 (0.37) ALDH1A1TAS1R3TAS1R1
SCHEMBL9105132 0.86 DRD4 (0.39) KMT2AMEN1
SCHEMBL9105136 0.86 DRD4 (0.39) KMT2AMEN1
SCHEMBL9103858 0.84 MAPT (0.43) —
SCHEMBL9103848 0.84 MAPT (0.43) —
SCHEMBL9103836 0.82 KDM4E (0.40) KMT2AMEN1ALDH1A1
SCHEMBL9104403 0.82 CYP2D6 (0.42) CYP2D6

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
WO-2025082731-A1 INTRANASAL FORMULATIONS FOR TREATING OBSTRUCTIVE SLEEP APNEA MOSANNA THERAPEUTICS AG (CH) 2025-04-24 — — WO disclosed
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