SCHEMBL8936028

SCHEMBL8936028

C#CCN(C)CCCNC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOB P27338 6/20 0.42
SIGMAR1 Q99720 3/20 0.40
APP P05067 2/20 0.40
HRH3 Q9Y5N1 1/20 0.40
KDM1A O60341 1/20 0.39
TMEM97 Q5BJF2 1/20 0.37
PYCR1 P32322 1/20 0.36
MAOA P21397 1/20 0.35

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
Hydrochloric Acid SCHEMBL8935980 0.98 MAOB (0.41) MAOBSIGMAR1APPHRH3KDM1A
SCHEMBL8936070 0.95 MAOB (0.44) MAOBSIGMAR1APPHRH3KDM1A
SCHEMBL8935963 0.94 MAOB (0.41) MAOBSIGMAR1APPHRH3KDM1A
SCHEMBL8936036 0.89 MAOB (0.38) MAOBSIGMAR1APPHRH3KDM1A
SCHEMBL3746698 0.81 ALDH1A1 (0.38) MAOBSIGMAR1APP
SCHEMBL18339127 0.81 SIGMAR1 (0.41) SIGMAR1APPTMEM97
SCHEMBL25206001 0.77 SIGMAR1 (0.39) SIGMAR1APPTMEM97
SCHEMBL8935964 0.77 MAOB (0.41) MAOBKDM1AMAOA
SCHEMBL29957195 0.75 MAOB (0.41) MAOBKDM1APYCR1MAOA
SCHEMBL21618575 0.75 MAOB (0.37) MAOBAPPHRH3PYCR1MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5480988-A USEFUL AS AN IMMUNOSUPPRESSANT, ANTIINFLAMMATORY AGENT, FUNGICIDE, ANTIGROWTH AGENT OR ANTITUMOR AGENT AMERICAN HOME PRODUCTS CORPORATION (US) 1996-01-02 US claimed
US-5559227-A IMMUNOSUPPRESSANT AMERICAN HOME PRODUCTS CORPORATION (US) 1996-09-24 US disclosed
US-5550133-A TREATING RHEUMATOID ARTHRITIS IN MAMMAL AMERICAN HOME PRODUCTS CORPORATION (US) 1996-08-27 US disclosed
US-5504204-A IMMUNOSUPPRESSIVE, ANTIINFLAMMATORY, ANTIFUNGAL, ANTIPROLIFERATIVE AND ANTITUMOR AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1996-04-02 US disclosed
US-5486522-A Carbamates of rapamycin AMERICAN HOME PRODUCTS CORPORATION (US) 1996-01-23 US disclosed
US-5486524-A RESTENOSIS AMERICAN HOME PRODUCTS CORPORATION (US) 1996-01-23 US disclosed
US-5486523-A ANTIINFLAMMATORY AMERICAN HOME PRODUCTS CORPORATION (US) 1996-01-23 US disclosed
US-5480988-A USEFUL AS AN IMMUNOSUPPRESSANT, ANTIINFLAMMATORY AGENT, FUNGICIDE, ANTIGROWTH AGENT OR ANTITUMOR AGENT AMERICAN HOME PRODUCTS CORPORATION (US) 1996-01-02 US disclosed