SCHEMBL20022351

SCHEMBL20022351

Cn1c2ccccc2c2cc(-c3ccc(-c4ccc(-c5ccc6c(c5)c5ccccc5n6C)s4)s3)ccc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR3 P46089 1/20 0.53
▸ KDM4E B2RXH2 4/20 0.50
▸ HPGD P15428 4/20 0.50
▸ MAPT P10636 3/20 0.50
▸ ALDH1A1 P00352 3/20 0.50
▸ HSD17B10 Q99714 3/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ HTT P42858 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ KIF11 P52732 1/20 0.45
▸ NPY5R Q15761 1/20 0.43
▸ PABPC1 P11940 1/20 0.42
▸ RXRA P19793 1/20 0.40
▸ RXRB P28702 1/20 0.40
▸ BCHE P06276 4/20 0.39
▸ ACHE P22303 4/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ RAB9A P51151 1/20 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
SCHEMBL20022303 1.00 GPR3 (0.53) GPR3KDM4EHPGDMAPTALDH1A1
SCHEMBL20022386 1.00 GPR3 (0.53) GPR3KDM4EHPGDMAPTALDH1A1
SCHEMBL20022381 1.00 GPR3 (0.53) GPR3KDM4EHPGDMAPTALDH1A1
SCHEMBL12418487 0.97 GPR3 (0.50) GPR3KDM4EHPGDMAPTALDH1A1
SCHEMBL13181224 0.90 KIF11 (0.50) GPR3KDM4EHPGDMAPTALDH1A1
SCHEMBL20022349 0.90 GPR3 (0.46) GPR3KDM4EHPGDMAPTALDH1A1
SCHEMBL8932254 0.89 GPR3 (0.48) GPR3KDM4EHPGDMAPTALDH1A1
SCHEMBL20022354 0.89 GPR3 (0.42) GPR3KDM4EHPGDMAPTALDH1A1
SCHEMBL20022387 0.85 GPR3 (0.39) GPR3KDM4EHPGDMAPTALDH1A1
SCHEMBL20022384 0.85 GPR3 (0.41) GPR3KDM4EHPGDMAPTALDH1A1

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
US-20180094192-A1 POLYMER NETWORKS UNIVERSITY OF HULL (GB) 2018-04-05 — — US disclosed
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