SCHEMBL7801239

SCHEMBL7801239

CON(C)C(=O)[C@@H](N)Cc1cccc2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NLN Q9BYT8 2/20 0.50
▸ MMP9 P14780 1/20 0.48
▸ ATM Q13315 1/20 0.46
▸ CTNNB1 P35222 1/20 0.46
▸ METAP2 P50579 7/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ SLC1A3 P43003 1/20 0.44
▸ SLC1A2 P43004 1/20 0.44
▸ SLC1A1 P43005 1/20 0.44
▸ METAP1 P53582 3/20 0.44
▸ TACR1 P25103 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP2D6 P10635 1/20 0.43
▸ CYP2C19 P33261 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
SCHEMBL14237833 0.81 NPC1 (0.41) —
SCHEMBL6018293 0.80 ATM (0.50) MMP9ATMCTNNB1L3MBTL1SLC1A3
SCHEMBL1902233 0.80 ATM (0.50) MMP9ATMCTNNB1L3MBTL1SLC1A3
Hydrochloric Acid SCHEMBL9632609 0.79 ATM (0.49) MMP9ATMCTNNB1L3MBTL1SLC1A3
Hydrochloric Acid SCHEMBL9630734 0.79 ATM (0.49) MMP9ATMCTNNB1L3MBTL1SLC1A3
Hydrochloric Acid SCHEMBL7066174 0.79 ATM (0.49) MMP9ATMCTNNB1L3MBTL1SLC1A3
SCHEMBL16450886 0.78 CTNNB1 (0.54) NLNMMP9CTNNB1L3MBTL1SLC1A3
SCHEMBL16261558 0.78 CTNNB1 (0.54) NLNMMP9CTNNB1L3MBTL1SLC1A3
SCHEMBL15686536 0.78 CTNNB1 (0.54) NLNMMP9CTNNB1L3MBTL1SLC1A3
SCHEMBL26768357 0.78 KDM4E (0.64) MMP9L3MBTL1TACR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0721449-B1 INHIBITORS OF BETA-AMYLOID PROTEIN PRODUCTION MERRELL PHARMA INC (US) 2001-12-19 — — EP disclosed
US-5977074-A THERAPY FOR ALZHEIMER'S DISEASE MERRELL PHARMACEUTICALS, INC. (US) 1999-11-02 — — US disclosed
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