SCHEMBL2563102

SCHEMBL2563102

O=Cc1c(C(F)(F)F)nn(-c2ccccc2F)c1Cl

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.38
ATM Q13315 1/20 0.38
KCNN4 O15554 3/20 0.37
HPGD P15428 1/20 0.36
KMT2A Q03164 1/20 0.36
CYP1A2 P05177 2/20 0.36
CYP2D6 P10635 1/20 0.36
LMNA P02545 1/20 0.34
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33
PIM1 P11309 1/20 0.33
PIM3 Q86V86 1/20 0.33
PIM2 Q9P1W9 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 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
SCHEMBL15331574 0.88 KMT2A (0.38) GAAATMKCNN4HPGDKMT2A
SCHEMBL2559493 0.87 RXRA (0.40) GAAHPGDKMT2ACYP1A2CYP2D6
SCHEMBL2559574 0.85 CYP1A2 (0.37) HPGDKMT2ACYP1A2CYP2D6PTGS1
SCHEMBL15330119 0.82 KMT2A (0.42) KCNN4HPGDKMT2A
SCHEMBL3381554 0.81 SMN1; SMN2 (0.43) CYP1A2CYP2D6LMNAPTGS1PTGS2
SCHEMBL20578432 0.80 HPGD (0.46) GAAKCNN4HPGDKMT2ALMNA
SCHEMBL15329895 0.78 KMT2A (0.39) KCNN4HPGDKMT2A
SCHEMBL15331113 0.78 HPGD (0.39) KCNN4HPGDKMT2APTGS2
SCHEMBL29950987 0.78 KCNN4 (0.42) KCNN4HPGDKMT2APIM1PIM3
SCHEMBL2552256 0.78 KCNN4 (0.37) KCNN4HPGDKMT2APIM1PIM3

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 7 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
EP-2558577-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2013-02-20 EP disclosed
WO-2011127933-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2011-10-20 WO disclosed