SCHEMBL9325860

SCHEMBL9325860

C=C(C(=O)OC)c1ccc(Oc2nc(Oc3ccc(C(=C)C(=O)OC)cc3)nc(Oc3ccc(C(=C)C(=O)OC)cc3)n2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.48
▸ MEN1 O00255 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ POLB P06746 2/20 0.46
▸ ACHE P22303 2/20 0.46
▸ BCHE P06276 1/20 0.46
▸ GAA P10253 2/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ SMN1; SMN2 Q16637 5/20 0.43
▸ TSHR P16473 2/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ TP53 P04637 1/20 0.43
▸ GLA P06280 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ PAX8 Q06710 1/20 0.42
▸ PARP10 Q53GL7 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ MAPT P10636 1/20 0.41
▸ HPGD P15428 1/20 0.41

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
SCHEMBL5057415 0.82 ALDH1A1 (0.46) ALDH1A1TSHRMAPT
SCHEMBL8897038 0.81 PARP10 (0.53) ALDH1A1POLBSMN1; SMN2TSHRNPC1
SCHEMBL4910445 0.80 CA1 (0.59) SMN1; SMN2NPC1TP53RAB9APARP10
SCHEMBL22407012 0.80 HPGD (0.50) ALDH1A1MEN1KMT2AL3MBTL1SMN1; SMN2
SCHEMBL24125032 0.79 GAA (0.64) ALDH1A1MEN1KMT2APOLBACHE
SCHEMBL30414504 0.78 PARP10 (0.57) ALDH1A1KMT2ASMN1; SMN2TSHRNPC1
Butane SCHEMBL7720074 0.74 TDP1 (0.41) ALDH1A1MAPTHPGD
SCHEMBL11620896 0.74 MAPT (0.72) ALDH1A1MEN1KMT2APOLBACHE
SCHEMBL4910303 0.74 CA1 (0.57) ALDH1A1MEN1KMT2AL3MBTL1TSHR
SCHEMBL9300725 0.74 TDP1 (0.57) ALDH1A1MEN1KMT2AGAASMN1; SMN2

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-0303108-B1 Light-sensitive composition, registration material prepared therefrom and process for the production of negative relief images HOECHST AG (DE) 1994-02-23 — — EP disclosed
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