SCHEMBL9452732

SCHEMBL9452732

CC(C)(c1ccc(Oc2ccc(N)cc2)cc1)c1ccc(Oc2ccc(N)cc2)cc1.Nc1ccc(Oc2ccc(-c3ccc(Oc4ccc(N)cc4)cc3)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.68
▸ MAPT P10636 5/20 0.68
▸ RAB9A P51151 4/20 0.68
▸ NPC1 O15118 3/20 0.68
▸ MAPK1 P28482 2/20 0.68
▸ HPGD P15428 1/20 0.68
▸ TDP1 Q9NUW8 5/20 0.56
▸ CYP3A4 P08684 3/20 0.56
▸ TSHR P16473 1/20 0.56
▸ TEAD4 Q15561 1/20 0.52
▸ POLB P06746 2/20 0.50
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ MAOA P21397 2/20 0.48
▸ KIF11 P52732 1/20 0.47
▸ MAOB P27338 1/20 0.47
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ MITF O75030 1/20 0.45
▸ GAA P10253 1/20 0.45
▸ GFER P55789 1/20 0.45

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
SCHEMBL9488956 1.00 ALDH1A1 (0.68) ALDH1A1MAPTRAB9ANPC1MAPK1
SCHEMBL28422125 1.00 ALDH1A1 (0.68) ALDH1A1MAPTRAB9ANPC1MAPK1
SCHEMBL13836578 0.94 ALDH1A1 (0.76) ALDH1A1MAPTRAB9ANPC1MAPK1
SCHEMBL204685 0.94 ALDH1A1 (0.76) ALDH1A1MAPTRAB9ANPC1MAPK1
SCHEMBL10391378 0.94 ALDH1A1 (0.76) ALDH1A1MAPTRAB9ANPC1MAPK1
SCHEMBL5071236 0.94 ALDH1A1 (0.76) ALDH1A1MAPTRAB9ANPC1MAPK1
SCHEMBL26840177 0.94 ALDH1A1 (0.76) ALDH1A1MAPTRAB9ANPC1MAPK1
SCHEMBL49650 0.94 ALDH1A1 (0.76) ALDH1A1MAPTRAB9ANPC1MAPK1
SCHEMBL2677985 0.94 ALDH1A1 (0.76) ALDH1A1MAPTRAB9ANPC1MAPK1
Ammonia Solution, Strong SCHEMBL3805933 0.92 ALDH1A1 (0.73) ALDH1A1MAPTRAB9ANPC1MAPK1

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-2023174773-A1 PHOTOALIGNING MATERIALS Rolic Technologies AG (CH) 2023-09-21 — — WO disclosed
US-5210175-A Catalyst of platinum, palladium or nickel EASTMAN KODAK COMPANY (US) 1993-05-11 — — US disclosed
Send feedback