SCHEMBL2557547

SCHEMBL2557547

Cc1ccc(C)c(-c2nc(C=O)c[nH]2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.40
HPGD P15428 3/20 0.40
KDM4E B2RXH2 3/20 0.40
GAA P10253 3/20 0.40
MAPT P10636 3/20 0.40
HSD17B10 Q99714 2/20 0.40
RECQL P46063 1/20 0.40
THRB P10828 1/20 0.38
SLC9A1 P19634 1/20 0.36
PIM3 Q86V86 1/20 0.35
FGFR1 P11362 1/20 0.33
FGFR2 P21802 1/20 0.33
BRD4 O60885 1/20 0.32
CASP3 P42574 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
SENP8 Q96LD8 1/20 0.32
SENP7 Q9BQF6 1/20 0.32
SENP6 Q9GZR1 1/20 0.32
MEN1 O00255 2/20 0.32

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
SCHEMBL29956222 1.00 ALDH1A1 (0.40) ALDH1A1HPGDKDM4EGAAMAPT
SCHEMBL2554570 0.88 FGFR1 (0.41) ALDH1A1HPGDKDM4EGAAMAPT
SCHEMBL15330457 0.86 NISCH (0.40) ALDH1A1HPGDKDM4EGAAMAPT
SCHEMBL2574740 0.82 GSK3A (0.33) ALDH1A1KDM4EGAAPIM3RAB9A
SCHEMBL2560000 0.77 AR (0.33) AR
SCHEMBL8963381 0.77 NISCH (0.42) ALDH1A1KDM4EMAPTCASP3RAB9A
SCHEMBL2562158 0.76 NPBWR1 (0.38) ALDH1A1KDM4EGAAMAPTRAB9A
Hydrochloric Acid SCHEMBL28564380 0.76 NISCH (0.41) ALDH1A1KDM4EMAPTRAB9ASMN1; SMN2
SCHEMBL15330717 0.76 KDM4E (0.35) ALDH1A1KDM4EMAPTSMN1; SMN2MEN1
SCHEMBL2555128 0.75 TRIM24 (0.37) ALDH1A1HPGDGAARAB9ASMN1; SMN2

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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