SCHEMBL7809080

SCHEMBL7809080

CC(O)c1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)c(-c2sccc2Br)n1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.34
RXFP1 Q9HBX9 2/20 0.34
NPC1 O15118 1/20 0.31
POLB P06746 1/20 0.31
PKM P14618 1/20 0.31
RAB9A P51151 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
LRRK2 Q5S007 1/20 0.31

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
SCHEMBL31359403 0.76 MEN1 (0.31) NPSR1
SCHEMBL6970351 0.74 CYP2A6 (0.38)
SCHEMBL7809084 0.72 SIRT2 (0.33)
SCHEMBL6963771 0.70
SCHEMBL7803953 0.65 KDM4E (0.34) MAPTNPC1RAB9A
SCHEMBL3502446 0.63 SMN1; SMN2 (0.30)
SCHEMBL6959823 0.62 CYP2A6 (0.35)
SCHEMBL12907335 0.62 CYP11B1 (0.37) MAPTRAB9ANPSR1
SCHEMBL7803940 0.62
SCHEMBL7809133 0.62 SIRT2 (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0889891-B1 4-[(THIEN-2-YL)METHYL]IMIDAZOLE DERIVATIVES HAVING ALPHA2-ADRENOCEPTOR AGONISTIC ACTIVITY ORTHO MCNEIL PHARM INC (US) 2001-06-06 EP disclosed
EP-0889891-A1 4-[(THIEN-2-YL)METHYL]IMIDAZOLE DERIVATIVES HAVING ALPHA2-ADRENOCEPTOR AGONISTIC ACTIVITY ORTHO PHARMACEUTICAL CORPORATION (US) 1999-01-13 EP disclosed
WO-1997035857-A1 4-[(THIEN-2-YL)METHYL]IMIDAZOLE DERIVATIVES HAVING ALPHA2-ADRENOCEPTOR AGONISTIC ACTIVITY ORTHO PHARMACEUTICAL CORPORATION (US) 1997-10-02 WO disclosed
US-5621113-A ALPHA 2 ADRENOCEPTOR AGONISTS ORTHO PHARMACEUTICAL CORPORATION (US) 1997-04-15 US disclosed