SCHEMBL30452017

SCHEMBL30452017

OCC(F)(F)c1ccc(Br)cc1Cl

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NT5E P21589 1/20 0.37
HSD11B1 P28845 1/20 0.35
ALDH1A1 P00352 3/20 0.35
RECQL P46063 1/20 0.34
CASP1 P29466 1/20 0.33
NOTUM Q6P988 1/20 0.33
TSHR P16473 3/20 0.32
LMNA P02545 2/20 0.32
HTT P42858 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
MAPK1 P28482 2/20 0.31
CYP3A4 P08684 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
PYCR1 P32322 1/20 0.31
TP53 P04637 1/20 0.31
MAPT P10636 1/20 0.31
THRB P10828 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
SCHEMBL24252824 1.00 NT5E (0.37) NT5EHSD11B1ALDH1A1RECQLCASP1
SCHEMBL30467765 0.96 NT5E (0.35) NT5EHSD11B1ALDH1A1RECQLCASP1
SCHEMBL16760268 0.81 NT5E (0.37) NT5EHSD11B1TSHRMAPK1CYP3A4
SCHEMBL30161845 0.81 NT5E (0.37) NT5EHSD11B1TSHRMAPK1CYP3A4
Hydrochloric Acid SCHEMBL30161934 0.80 NT5E (0.36) NT5EHSD11B1TSHRMAPK1CYP3A4
Hydrochloric Acid SCHEMBL21995396 0.80 NT5E (0.36) NT5EHSD11B1TSHRMAPK1CYP3A4
SCHEMBL17713108 0.79 DGAT1 (0.39) ALDH1A1CASP1LMNACYP3A4PYCR1
SCHEMBL31466467 0.79 DGAT1 (0.39) ALDH1A1CASP1LMNACYP3A4PYCR1
SCHEMBL17713136 0.79 KDM1A (0.41) CASP1NOTUM
SCHEMBL29589267 0.78 NT5E (0.46) NT5EHSD11B1NOTUMTSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116947903-A Inhibitors of complement factors and uses thereof 安尼艾克松股份有限公司 2023-10-27 CN disclosed
CN-116261564-A Inhibitors of complement factors and uses thereof 安尼艾克松股份有限公司 2023-06-13 CN disclosed
EP-4185592-A1 INHIBITORS OF COMPLEMENT FACTORS AND USES THEREOF Annexon, Inc. (US) 2023-05-31 EP disclosed