SCHEMBL15329436

SCHEMBL15329436

Cc1nnc(SCCC=O)[nH]1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.43
GAA P10253 1/20 0.43
KDM4E B2RXH2 1/20 0.40
CYP2C9 P11712 2/20 0.39
CYP2C19 P33261 2/20 0.39
CYP1A2 P05177 1/20 0.39
TDP1 Q9NUW8 1/20 0.35
LMNA P02545 3/20 0.34
POLB P06746 4/20 0.33
GPR84 Q9NQS5 1/20 0.31
ALDH1A1 P00352 3/20 0.31
HPGD P15428 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL15331443 0.81 SMN1; SMN2 (0.38) SMN1; SMN2GAAKDM4ECYP2C9CYP2C19
SCHEMBL6959750 0.64
SCHEMBL15332741 0.63 PKM (0.44) SMN1; SMN2GAATDP1LMNAPOLB
SCHEMBL1064759 0.63 FDPS (0.50) SMN1; SMN2TDP1LMNAPOLBGPR84
SCHEMBL15330921 0.63 ALDH1A1 (0.58) GAAKDM4ECYP2C9CYP2C19CYP1A2
SCHEMBL6959747 0.62
SCHEMBL15928188 0.60 POLB (0.55) SMN1; SMN2GAACYP2C9CYP2C19CYP1A2
SCHEMBL1751657 0.59 ADH1B (0.33)
SCHEMBL7514361 0.59 ALDH1A1 (0.49) SMN1; SMN2CYP2C9CYP2C19CYP1A2TDP1
SCHEMBL15330989 0.57

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-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-11225655-B2 Bi-functional complexes and methods for making and using such complexes NUEVOLUTION A/S (DK) 2022-01-18 US disclosed
EP-3540059-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2019-09-18 EP disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 EP disclosed
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 US disclosed