SCHEMBL2562286

SCHEMBL2562286

O=Cc1cnn(-c2cc(F)ccc2F)c1Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 6/20 0.35
ALDH1A1 P00352 2/20 0.34
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ERN1 O75460 2/20 0.33
F2 P00734 1/20 0.33
PLAU P00749 1/20 0.33
KLKB1 P03952 1/20 0.33
ELANE P08246 1/20 0.33
RIPK1 Q13546 1/20 0.33
ESR1 P03372 1/20 0.33
NPBWR1 P48145 1/20 0.32
MCHR1 Q99705 1/20 0.32
P2RX7 Q99572 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
GPR35 Q9HC97 1/20 0.31
KCNN4 O15554 1/20 0.31

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
SCHEMBL15331537 0.88 ALDH1A1 (0.37) MAPK14ALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL2562380 0.88 GPR35 (0.37) MAPK14ALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL15331857 0.85 CYP17A1 (0.40) MAPK14ALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL2559318 0.82 MAPK14 (0.35) MAPK14ALDH1A1KDM4EERN1ESR1
SCHEMBL15331081 0.82 KCNN4 (0.46) MAPK14SMN1; SMN2KCNN4
SCHEMBL15330970 0.78 ALDH1A1 (0.41) MAPK14ALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL2554507 0.78 PTGS1 (0.36) MAPK14ALDH1A1LMNASMN1; SMN2ERN1
SCHEMBL15332373 0.77 MAPK14 (0.43) MAPK14ALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL15331211 0.77 ALDH1A1 (0.43) ALDH1A1ESR1
SCHEMBL15332944 0.76 TDP1 (0.49) ALDH1A1LMNAERN1TDP1L3MBTL1

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