SCHEMBL15329706

SCHEMBL15329706

Cn1nc(-c2c(Cl)cccc2Cl)c(C=O)c1Cl

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
TDP1 Q9NUW8 2/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
CYP1A2 P05177 2/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.37
MAPT P10636 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
RECQL P46063 2/20 0.35
KDM4E B2RXH2 1/20 0.35
TSHR P16473 1/20 0.34
ATM Q13315 1/20 0.34
CCR4 P51679 1/20 0.34
CRHR1 P34998 1/20 0.33
NPSR1 Q6W5P4 2/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL2558228 0.90 KMT2A (0.40) ALDH1A1TDP1MEN1KMT2ACYP1A2
SCHEMBL15330348 0.86 ALDH1A1 (0.42) ALDH1A1TDP1MEN1KMT2ACYP1A2
SCHEMBL2554265 0.84 ALDH1A1 (0.43) ALDH1A1TDP1MEN1KMT2ACYP1A2
SCHEMBL2562457 0.84 CYP1A2 (0.39) ALDH1A1TDP1MEN1KMT2ACYP1A2
SCHEMBL15331588 0.83 MAPT (0.43) ALDH1A1TDP1MEN1KMT2ACYP1A2
SCHEMBL2551877 0.82 CCR4 (0.40) ALDH1A1TDP1MEN1KMT2ACYP1A2
SCHEMBL15331617 0.80 ALDH1A1 (0.42) ALDH1A1TDP1MEN1KMT2ACYP1A2
SCHEMBL2076094 0.79 RECQL (0.53) ALDH1A1TDP1MEN1KMT2ACYP1A2
SCHEMBL15332407 0.77 CYP1A2 (0.50) ALDH1A1TDP1MEN1KMT2ACYP1A2
SCHEMBL15329566 0.76 CYP1A2 (0.43) TDP1CYP1A2CYP2C9CYP2C19MAPT

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
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
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 US disclosed