SCHEMBL27397141

SCHEMBL27397141

Cn1cc(C(=O)N2CCN(N)CC2)cn1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PROKR1 Q8TCW9 3/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ CYP11B1 P15538 1/20 0.42
▸ CYP11B2 P19099 1/20 0.42
▸ CCNC P24863 1/20 0.41
▸ CDK8 P49336 1/20 0.41
▸ POLB P06746 2/20 0.41
▸ RET P07949 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ CCNK O75909 1/20 0.39
▸ CDK12 Q9NYV4 1/20 0.39
▸ NAMPT P43490 3/20 0.39
▸ MKNK1 Q9BUB5 1/20 0.38
▸ MKNK2 Q9HBH9 1/20 0.38
▸ GRN P28799 1/20 0.38
▸ SORT1 Q99523 1/20 0.38

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
SCHEMBL18390549 0.86 POLB (0.54) PROKR1RAB9ASMN1; SMN2POLBMEN1
SCHEMBL17714090 0.85 PROKR1 (0.48) PROKR1RAB9ASMN1; SMN2CYP11B1CYP11B2
SCHEMBL2386331 0.84 PROKR1 (0.57) PROKR1RAB9ASMN1; SMN2CCNCCDK8
SCHEMBL12108484 0.84 PROKR1 (0.57) PROKR1RAB9ASMN1; SMN2CCNCCDK8
SCHEMBL27153827 0.81 AKR1C1 (0.49) PROKR1RAB9ASMN1; SMN2CYP11B1CYP11B2
SCHEMBL18705015 0.81 HRH3 (0.56) PROKR1RAB9ASMN1; SMN2
SCHEMBL29051582 0.80 SMN1; SMN2 (0.50) PROKR1RAB9ASMN1; SMN2CYP11B1CYP11B2
SCHEMBL17714082 0.80 SIGMAR1 (0.53) PROKR1RAB9ASMN1; SMN2CYP11B1CYP11B2
SCHEMBL9104445 0.80 SMN1; SMN2 (0.53) PROKR1RAB9ASMN1; SMN2CCNCCDK8
SCHEMBL25848891 0.79 ACHE (0.57) PROKR1RAB9ASMN1; SMN2

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-3958867-B1 SMALL MOLECULE BROMODOMAIN INHIBITORS AND USES THEREOF CONVERGENE LLC (US) 2024-06-26 — — EP disclosed
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