SCHEMBL2554570

SCHEMBL2554570

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

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 2/20 0.41
FGFR2 P21802 2/20 0.41
NPBWR1 P48145 1/20 0.39
MAPT P10636 4/20 0.38
GAA P10253 1/20 0.38
HSP90AB1 P08238 4/20 0.36
FGFR3 P22607 1/20 0.36
ALPL P05186 2/20 0.36
LMNA P02545 1/20 0.36
CA9 Q16790 1/20 0.36
NPC1 O15118 3/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
KDM4E B2RXH2 2/20 0.36
ATM Q13315 1/20 0.36
RAB9A P51151 2/20 0.33
ALDH1A1 P00352 2/20 0.33
PIM3 Q86V86 1/20 0.32
HPGD P15428 1/20 0.32
SMN1; SMN2 Q16637 1/20 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 0.88 ALDH1A1 (0.40) FGFR1FGFR2MAPTGAAMEN1
SCHEMBL2557547 0.88 ALDH1A1 (0.40) FGFR1FGFR2MAPTGAAMEN1
SCHEMBL2574740 0.85 GSK3A (0.33) GAANPC1MEN1KMT2AKDM4E
SCHEMBL15330457 0.83 NISCH (0.40) MAPTGAANPC1MEN1KMT2A
SCHEMBL15330717 0.79 KDM4E (0.35) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL2560000 0.77 AR (0.33)
SCHEMBL8963381 0.77 NISCH (0.42) MAPTNPC1MEN1KMT2AKDM4E
Hydrochloric Acid SCHEMBL28564380 0.76 NISCH (0.41) NPBWR1MAPTNPC1MEN1KMT2A
SCHEMBL2555128 0.75 TRIM24 (0.37) GAANPC1RAB9AALDH1A1HPGD
SCHEMBL29951229 0.75 PIN1 (0.44) NPBWR1NPC1RAB9A

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
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
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
US-RE30511-E ENZYME INHIBITOR, HERBICIDE, CYCLIZATION AMERICAN CYANAMID COMPANY (US) 1981-02-10 US disclosed
US-4107307-A ENZYME INHIBITORS, HERBICIDES, RING CLOSURE AMERICAN CYANAMID COMPANY (US) 1978-08-15 US disclosed