SCHEMBL29890650

SCHEMBL29890650

FC(F)(F)c1ccc(Cl)cc1Br

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ TMPRSS4 Q9NRS4 4/20 0.41
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ EPAS1 Q99814 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ NOS3 P29474 1/20 0.36
▸ NOS1 P29475 1/20 0.36
▸ NOS2 P35228 1/20 0.36
▸ PTP4A3 O75365 1/20 0.36
▸ PDK2 Q15119 1/20 0.35
▸ AR P10275 1/20 0.35
▸ KDM4E B2RXH2 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
SCHEMBL3324051 1.00 NOTUM (0.44) NOTUML3MBTL1CYP3A4TSHRMAPK1
SCHEMBL1410268 0.82 TMPRSS4 (0.51) NOTUML3MBTL1CYP3A4TSHRMAPK1
SCHEMBL31193921 0.82 TMPRSS4 (0.51) NOTUML3MBTL1CYP3A4TSHRMAPK1
SCHEMBL11550638 0.79 TSHR (0.60) L3MBTL1CYP3A4TSHRMAPK1TDP1
SCHEMBL3789153 0.78 CYP3A4 (0.52) CYP3A4TSHRMAPK1TDP1TMPRSS4
SCHEMBL12251280 0.77 TSHR (0.41) CYP3A4TSHRMAPK1TDP1CYP1A2
SCHEMBL672252 0.76 NOTUM (0.47) NOTUML3MBTL1TSHRMAPK1TDP1
SCHEMBL29403188 0.76 TSHR (0.62) NOTUMCYP3A4TSHRMAPK1TDP1
SCHEMBL107751 0.76 TSHR (0.62) NOTUMCYP3A4TSHRMAPK1TDP1
SCHEMBL5865588 0.75 CYP3A4 (0.53) NOTUML3MBTL1CYP3A4TSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4185592-A1 INHIBITORS OF COMPLEMENT FACTORS AND USES THEREOF Annexon, Inc. (US) 2023-05-31 — — EP disclosed
CN-110248940-B Aryl hydrocarbon receptor (AhR) modulator compounds 菲尼克斯药品股份公司 2022-07-01 — — CN disclosed
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