SCHEMBL2554190

SCHEMBL2554190

CC(Oc1ccc(Cl)cc1C=O)C(N)=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.49
▸ HTR2A P28223 1/20 0.49
▸ HTR2C P28335 1/20 0.49
▸ HTR2B P41595 1/20 0.49
▸ GAA P10253 2/20 0.47
▸ ALOX12 P18054 2/20 0.45
▸ HPGD P15428 2/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ GLA P06280 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ CYP2D6 P10635 1/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ PTGDR2 Q9Y5Y4 2/20 0.44
▸ PTGDR Q13258 1/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ ERN1 O75460 3/20 0.44
▸ KDM4E B2RXH2 2/20 0.42
▸ LMNA P02545 2/20 0.41
▸ ALDH1A1 P00352 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
SCHEMBL3936165 0.87 TSHR (0.66) TSHRHTR2AHTR2CHTR2BGAA
SCHEMBL15332582 0.87 TSHR (0.66) TSHRHTR2AHTR2CHTR2BGAA
SCHEMBL2560123 0.85 SMN1; SMN2 (0.48) TSHRHTR2AHTR2CHTR2BGAA
SCHEMBL1332620 0.84 TSHR (0.48) TSHRHTR2AHTR2CHTR2BGAA
SCHEMBL15329716 0.84 SRC (0.42) TSHRHTR2AHTR2CHTR2BGAA
SCHEMBL15332505 0.83 SMN1; SMN2 (0.51) TSHRHTR2AHTR2CHTR2BGAA
SCHEMBL2555552 0.82 PTGDR2 (0.51) TSHRALOX12HPGDPTGDR2SMN1; SMN2
SCHEMBL2553829 0.82 SMN1; SMN2 (0.50) TSHRHTR2AHTR2CHTR2BGAA
SCHEMBL2560273 0.82 MEN1 (0.43) TSHRHTR2AHTR2CHTR2BGAA
SCHEMBL21056089 0.81 SMN1; SMN2 (0.62) TSHRHTR2AHTR2CHTR2BGAA

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
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