SCHEMBL2558495

SCHEMBL2558495

O=Cc1ccc(N2CCNC(=O)C2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 1/20 0.53
TRIM33 Q9UPN9 1/20 0.53
ALDH1A1 P00352 5/20 0.51
KDM4E B2RXH2 3/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
MAOB P27338 1/20 0.43
RORC P51449 1/20 0.40
GAA P10253 1/20 0.39
SYK P43405 1/20 0.38
MAPK1 P28482 1/20 0.37
ACHE P22303 3/20 0.36
PRKCH P24723 1/20 0.36
PRKCE Q02156 1/20 0.36
CCNT1 O60563 1/20 0.36
CDK4 P11802 1/20 0.36
CCND1 P24385 1/20 0.36
CCND3 P30281 1/20 0.36
CDK9 P50750 1/20 0.36
CDK6 Q00534 1/20 0.36
PTGS2 P35354 1/20 0.35

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
SCHEMBL2559035 0.85 TRIM24 (0.56) TRIM24TRIM33ALDH1A1KDM4ESMN1; SMN2
SCHEMBL3125646 0.79 DDB1 (0.46) ALDH1A1KDM4ESMN1; SMN2RORCGAA
SCHEMBL10999156 0.79 ADRB1 (0.56) SMN1; SMN2RORCSYKPRKCHPRKCE
SCHEMBL12208591 0.79 HTR3E (0.56) SMN1; SMN2RORCGAA
SCHEMBL15055212 0.79 HTR3E (0.53) ALDH1A1RORCPTGS2
Hydrochloric Acid SCHEMBL12520575 0.78 AOC3 (0.47) ALDH1A1KDM4ESMN1; SMN2MAOBRORC
SCHEMBL7334933 0.77 ADRB2 (0.58) ALDH1A1KDM4ERORCSYKPRKCH
SCHEMBL559578 0.77 TRIM24 (0.68) TRIM24TRIM33ALDH1A1KDM4ESMN1; SMN2
SCHEMBL19066690 0.77 KDM4E (0.49) KDM4ERORCGAASYK
SCHEMBL2557448 0.76 ALDH1A1 (0.60) ALDH1A1SMN1; SMN2GAAMAPK1PRKCH

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 8 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
CN-109563092-B 2-phenylimidazo [4,5-B ] pyridin-7-amine derivatives useful as inhibitors of the activity of the mammalian tyrosine kinase ROR1 坎塞拉有限公司 2021-09-14 CN 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