SCHEMBL20818488

SCHEMBL20818488

O=Cc1c(F)cccc1C(F)F

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 1/20 0.39
ALDH1A1 P00352 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
NFE2L2 Q16236 2/20 0.36
IKBKB O14920 1/20 0.35
CES2 O00748 3/20 0.33
CES1 P23141 3/20 0.33
ABCG2 Q9UNQ0 1/20 0.33
POLB P06746 1/20 0.33
KCNH2 Q12809 2/20 0.31
MAT2A P31153 1/20 0.31
PKM P14618 1/20 0.31
PKLR P30613 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
SCHEMBL11987671 0.87 MEN1 (0.42) ERN1ALDH1A1MEN1KMT2ATDP1
SCHEMBL15614299 0.82 GABRA1 (0.40) ERN1ALDH1A1MEN1KMT2ATDP1
SCHEMBL95708 0.79 ERN1 (0.50) ERN1ALDH1A1MEN1KMT2ATDP1
SCHEMBL18797733 0.78 ALDH1A1 (0.35) ERN1ALDH1A1MEN1KMT2ATDP1
SCHEMBL16634677 0.78 ALDH1A1 (0.61) ALDH1A1MEN1KMT2ATDP1POLB
SCHEMBL18570190 0.77 ERN1 (0.35) ERN1ALDH1A1MEN1KMT2ATDP1
SCHEMBL652253 0.71 ERN1 (0.59) ERN1ALDH1A1MEN1KMT2ATDP1
SCHEMBL4743962 0.71 ERN1 (0.44) ERN1ALDH1A1MEN1KMT2ATDP1
SCHEMBL29602790 0.71 ERN1 (0.44) ERN1ALDH1A1MEN1KMT2ATDP1
SCHEMBL16793363 0.71 DRD1 (0.46) ERN1ALDH1A1MEN1KMT2ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3941475-A1 PYRIDAZINONES AND METHODS OF USE THEREOF Goldfinch Bio, Inc. (US) 2022-01-26 EP disclosed
WO-2020191056-A1 PYRIDAZINONES AND METHODS OF USE THEREOF GOLDFINCH BIO, INC. (US) 2020-09-24 WO disclosed
EP-3684364-A2 PYRIDAZINONES AND METHODS OF USE THEREOF Goldfinch Bio, Inc. (US) 2020-07-29 EP disclosed
WO-2019055966-A2 PYRIDAZINONES AND METHODS OF USE THEREOF GOLDFINCH BIO, INC. (US) 2019-03-21 WO disclosed