SCHEMBL8026892

SCHEMBL8026892

CN(C)CCc1ccccc1S(=O)(=O)Nc1ccc2c(c1)nc(Cc1ccc(C#N)cc1)n2C

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
F2 P00734 9/20 0.53
PAX8 Q06710 3/20 0.43
POLB P06746 1/20 0.43
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
HTR6 P50406 3/20 0.41
BRPF1 P55201 2/20 0.41
BRD1 O95696 1/20 0.41
ALDH1A1 P00352 1/20 0.41
PKM P14618 1/20 0.41

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
SCHEMBL8032038 0.89 F2 (0.46) F2LMNASMN1; SMN2HTR6BRPF1
SCHEMBL8015857 0.86 BRD4 (0.46) F2PAX8POLBLMNAHTR6
SCHEMBL8016793 0.85 F2 (0.59) F2PAX8POLBLMNASMN1; SMN2
SCHEMBL8032566 0.85 F2 (0.46) F2LMNASMN1; SMN2HTR6BRPF1
SCHEMBL8029677 0.85 F2 (0.44) F2HTR6
SCHEMBL8031467 0.84 F2 (0.44) F2HTR6BRPF1BRD1
SCHEMBL8033079 0.84 F2 (0.49) F2HTR6
SCHEMBL8027001 0.84 F2 (0.74) F2PAX8POLBLMNASMN1; SMN2
SCHEMBL8026369 0.84 F2 (0.43) F2HTR6
SCHEMBL8032464 0.83 F2 (0.53) F2PAX8POLBLMNASMN1; 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
US-6114532-A ANTICOAGULANT BOEHRINGER INGELHEIM PHARMA KG (DE) 2000-09-05 US disclosed