SCHEMBL8549178

SCHEMBL8549178

CCCN[C@H](CO)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.49
MAN2A1 Q16706 3/20 0.46
MAN1B1 Q9UKM7 3/20 0.46
SIGMAR1 Q99720 1/20 0.46
MAN2B1 O00754 3/20 0.44
GPR88 Q9GZN0 3/20 0.43
EPHX2 P34913 2/20 0.42
MTOR P42345 1/20 0.42
RAB9A P51151 1/20 0.42
GRM7 Q14831 1/20 0.42
METAP2 P50579 1/20 0.42
METAP1 P53582 1/20 0.42
LMNA P02545 1/20 0.41
CYP3A4 P08684 1/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
TRPA1 O75762 1/20 0.41
ALDH1A1 P00352 1/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL8549011 1.00 RIPK1 (0.49) RIPK1MAN2A1MAN1B1SIGMAR1MAN2B1
SCHEMBL8545776 1.00 RIPK1 (0.49) RIPK1MAN2A1MAN1B1SIGMAR1MAN2B1
SCHEMBL25590552 0.86 NAAA (0.51) RIPK1GPR88ALDH1A1POLBMAPT
SCHEMBL19954198 0.85 TRPA1 (0.43) RIPK1SIGMAR1MTORRAB9AGRM7
SCHEMBL258306 0.84 MAN2A1 (0.49) RIPK1MAN2A1MAN1B1MAN2B1GPR88
SCHEMBL13520315 0.84 RIPK1 (0.51) RIPK1MAN2A1MAN1B1SIGMAR1MAN2B1
SCHEMBL13911223 0.84 SIGMAR1 (0.48) SIGMAR1EPHX2MTORRAB9AGRM7
SCHEMBL3165645 0.84 RIPK1 (0.51) RIPK1MAN2A1MAN1B1SIGMAR1MAN2B1
SCHEMBL10282547 0.84 RIPK1 (0.51) RIPK1MAN2A1MAN1B1SIGMAR1MAN2B1
SCHEMBL12609158 0.84 HTT (0.46) RIPK1MAN2A1MAN1B1MAN2B1GPR88

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5821255-A REGULATING THE SECRETION OF CORTICOTROPIN, BETA-ENDORPHIN OR PEPTIDES DERIVED FROM PROOPIOMELANOCORTIN SANOFI (FR) 1998-10-13 US disclosed
EP-0659747-B1 Branched aminothiazole derivatives process for their preparation and pharmaceutical compositions containing them SANOFI SA (FR) 1998-04-01 EP disclosed
US-5602132-A USEFUL IN TREATMENT OF PATHOLOGIES INVOLVING CORTICOTROPIN RELEASING FACTOR SANOFI (FR) 1997-02-11 US disclosed
CN-1127252-A Branched-amino-sbustituted thiazoles, processes for their preparation and the pharmaceutical compositions which contain them SANOFI SA (FR) 1996-07-24 CN disclosed
EP-0659747-A1 Branched aminothiazole derivatives process for their preparation and pharmaceutical compositions containing them SANOFI (FR) 1995-06-28 EP disclosed