SCHEMBL25865367

SCHEMBL25865367

C=C(C)C(=C)Nc1ccccc1C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 6/20 0.59
▸ ALDH1A1 P00352 3/20 0.59
▸ NPC1 O15118 2/20 0.55
▸ RAB9A P51151 2/20 0.55
▸ SIGMAR1 Q99720 4/20 0.50
▸ POLB P06746 2/20 0.50
▸ GRIN2D O15399 2/20 0.49
▸ GRIN3B O60391 2/20 0.49
▸ GRIN1 Q05586 2/20 0.49
▸ GRIN2A Q12879 2/20 0.49
▸ GRIN2B Q13224 2/20 0.49
▸ GRIN2C Q14957 2/20 0.49
▸ GRIN3A Q8TCU5 2/20 0.49
▸ EPHX1 P07099 1/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ PABPC1 P11940 1/20 0.49
▸ ALOX15 P16050 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ EBP Q15125 1/20 0.49

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
SCHEMBL11125037 0.83 HPGD (0.63) HPGDALDH1A1NPC1RAB9ASIGMAR1
SCHEMBL24938674 0.82 NPC1 (0.60) HPGDALDH1A1NPC1RAB9ASIGMAR1
SCHEMBL18599981 0.82 HPGD (0.53) HPGDALDH1A1NPC1RAB9ASIGMAR1
SCHEMBL959541 0.82 NPC1 (0.77) HPGDALDH1A1NPC1RAB9ASIGMAR1
SCHEMBL12139537 0.81 NPC1 (0.57) HPGDALDH1A1NPC1RAB9ASIGMAR1
SCHEMBL13433106 0.80 NPC1 (0.61) HPGDALDH1A1NPC1RAB9ASIGMAR1
SCHEMBL8432028 0.80 RAB9A (0.62) HPGDALDH1A1NPC1RAB9APOLB
SCHEMBL14223269 0.76 HPGD (0.55) HPGDALDH1A1NPC1RAB9ASIGMAR1
SCHEMBL14223256 0.76 HPGD (0.55) HPGDALDH1A1NPC1RAB9ASIGMAR1
SCHEMBL24732254 0.76 HPGD (0.55) HPGDALDH1A1NPC1RAB9ASIGMAR1

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
WO-2024017977-A1 IMIDAZOPYRIDINE COMPOUNDS, PREPARATION THEREOF AND THERAPEUTIC USES THEREOF SANOFI (FR) 2024-01-25 — — WO disclosed
WO-2023135582-A1 NEW STEREORETENTIVE RUTHENIUM COMPLEXES, METHOD OF THEIR PREPARATION, INTERMEDIATES USED IN THIS METHOD AND USE OF NEW STEREORETENTIVE RUTHENIUM COMPLEXES IN OLEFIN METATHESIS REACTIONS UNIWERSYTET WARSZAWSKI (PL) 2023-07-20 — — WO disclosed
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