SCHEMBL24425997

SCHEMBL24425997

C=C(C)/C=C\c1cccc(N)c1C

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ PIK3CA P42336 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.38
▸ IAPP P10997 1/20 0.35
▸ LMNA P02545 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ CD44 P16070 1/20 0.32
▸ KDM4E B2RXH2 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
SCHEMBL8295301 0.83 MAPT (0.40) CYP3A4TSHRALDH1A1IAPPLMNA
SCHEMBL14448435 0.80 IAPP (0.47) IAPPLMNAMAPTKDM4E
SCHEMBL16507826 0.79 CD44 (0.41) TSHRALDH1A1IAPPLMNAMAPT
SCHEMBL15949912 0.79 CA1 (0.50) CYP3A4TSHRPIK3CALMNAMAPT
SCHEMBL19732049 0.77 KDM4E (0.51) CYP3A4ALDH1A1LMNAMAPTKDM4E
SCHEMBL8661727 0.76 MAPT (0.47) CYP3A4ALDH1A1IAPPLMNAMAPT
SCHEMBL13210354 0.74 CYP3A4 (0.48) CYP3A4TSHRPIK3CAALDH1A1CD44
SCHEMBL8349013 0.73 TSHR (0.45) TSHRALDH1A1IAPPLMNAMAPT
SCHEMBL2961735 0.73 TSHR (0.45) TSHRALDH1A1IAPPLMNAMAPT
SCHEMBL1123463 0.72 CYP3A4 (0.56) CYP3A4TSHRPIK3CAALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3998070-A1 MIR-124 AS A BIOMARKER FOR THE TREATMENT OF INFLAMMATORY DISEASES ABIVAX (FR) 2022-05-18 — — EP disclosed
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