SCHEMBL25795068

SCHEMBL25795068

O=C(c1cc2ccc(Br)cc2[nH]1)N1CCC1

nearest known ligand 0.78

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 11/20 0.78
HRH3 Q9Y5N1 3/20 0.61
GPR183 P32249 5/20 0.61
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
POLB P06746 2/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51

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
SCHEMBL6130840 0.87 HRH4 (1.00) HRH4HRH3NPC1RAB9A
SCHEMBL16598933 0.87 HRH4 (0.76) HRH4HRH3GPR183NPC1RAB9A
SCHEMBL377743 0.85 HRH4 (0.78) HRH4HRH3GPR183NPC1RAB9A
SCHEMBL20618075 0.82 HRH4 (0.64) HRH4HRH3GPR183POLBMEN1
SCHEMBL26490234 0.82 HRH4 (0.68) HRH4HRH3GPR183NPC1RAB9A
SCHEMBL16598725 0.80 HRH4 (0.65) HRH4HRH3GPR183POLBSMN1; SMN2
SCHEMBL26074492 0.80 HRH4 (0.65) HRH4HRH3GPR183POLBMEN1
SCHEMBL12334085 0.79 NPC1 (0.77) HRH4HRH3NPC1RAB9AMEN1
SCHEMBL17938753 0.79 GPR183 (0.67) HRH4HRH3GPR183NPC1RAB9A
SCHEMBL16306806 0.78 GPR183 (0.64) HRH4HRH3GPR183NPC1RAB9A

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
EP-4206197-A1 PREPARATION METHOD FOR NOVEL RHO-RELATED PROTEIN KINASE INHIBITOR AND INTERMEDIATE IN PREPARATION METHOD Beijing Tide Pharmaceutical Co., Ltd. (CN) 2023-07-05 EP disclosed