SCHEMBL11780555

SCHEMBL11780555

O=[C]C=Cc1ccc(C=CC(=O)CCC(=O)O)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.67
▸ RAB9A P51151 5/20 0.66
▸ KMT2A Q03164 3/20 0.66
▸ NPC1 O15118 3/20 0.60
▸ POLB P06746 1/20 0.60
▸ SMN1; SMN2 Q16637 1/20 0.60
▸ KDM4E B2RXH2 2/20 0.57
▸ HTT P42858 1/20 0.57
▸ AKR1B10 O60218 2/20 0.44
▸ AKR1B1 P15121 2/20 0.44
▸ MAOB P27338 1/20 0.44
▸ PTGS2 P35354 1/20 0.44
▸ GLO1 Q04760 1/20 0.44
▸ CAMK2A Q9UQM7 1/20 0.44
▸ HAO1 Q9UJM8 1/20 0.41
▸ IAPP P10997 3/20 0.41
▸ GSK3B P49841 2/20 0.40
▸ HSP90AA1 P07900 1/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ BACE1 P56817 3/20 0.39

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
SCHEMBL1285623 0.80 ALDH1A1 (1.00) ALDH1A1RAB9AKMT2ANPC1POLB
SCHEMBL1285622 0.80 ALDH1A1 (1.00) ALDH1A1RAB9AKMT2ANPC1POLB
SCHEMBL8775394 0.79 RAB9A (1.00) ALDH1A1RAB9AKMT2ANPC1POLB
SCHEMBL8685645 0.79 ALDH1A1 (0.71) ALDH1A1RAB9AKMT2ANPC1POLB
SCHEMBL8775882 0.79 RAB9A (1.00) ALDH1A1RAB9AKMT2ANPC1POLB
SCHEMBL8685642 0.79 ALDH1A1 (0.71) ALDH1A1RAB9AKMT2ANPC1POLB
SCHEMBL10971774 0.76 ALDH1A1 (0.71) ALDH1A1RAB9AKMT2ANPC1POLB
SCHEMBL27544322 0.75 RAB9A (0.69) ALDH1A1RAB9AKMT2ANPC1POLB
SCHEMBL13039630 0.74 ALDH1A1 (0.88) ALDH1A1RAB9AKMT2ANPC1POLB
SCHEMBL28912353 0.69 RAB9A (0.66) ALDH1A1RAB9AKMT2ANPC1POLB

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
US-3936307-A Light and heat sensitive composition for producing a colored transfer complex image MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JA) 1976-02-03 — — US claimed
US-3936307-A Light and heat sensitive composition for producing a colored transfer complex image MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JA) 1976-02-03 — — US disclosed
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