SCHEMBL16606224

SCHEMBL16606224

CCCCCCCCCCCCCCCCOC(=O)c1ccc2ccccc2c1

nearest known ligand 0.72

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 2/20 0.61
▸ DRD3 P35462 1/20 0.61
▸ ALDH1A1 P00352 2/20 0.60
▸ TSHR P16473 2/20 0.60
▸ LMNA P02545 1/20 0.60
▸ NPC1 O15118 1/20 0.60
▸ MAPT P10636 1/20 0.60
▸ RAB9A P51151 1/20 0.60
▸ TP53 P04637 1/20 0.58
▸ CYP3A4 P08684 1/20 0.58
▸ MAPK1 P28482 1/20 0.58
▸ ESR1 P03372 3/20 0.56
▸ AKR1C4 P17516 1/20 0.56
▸ AKR1C3 P42330 1/20 0.56
▸ AKR1C2 P52895 1/20 0.56
▸ AKR1C1 Q04828 1/20 0.56
▸ STS P08842 5/20 0.56
▸ CNR2 P34972 1/20 0.56

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
SCHEMBL6932101 1.00 HRH3 (0.61) HRH3DRD3ALDH1A1TSHRLMNA
SCHEMBL20100236 1.00 HRH3 (0.61) HRH3DRD3ALDH1A1TSHRLMNA
SCHEMBL3157861 1.00 HRH3 (0.61) HRH3DRD3ALDH1A1TSHRLMNA
SCHEMBL20100235 1.00 HRH3 (0.61) HRH3DRD3ALDH1A1TSHRLMNA
SCHEMBL11527051 0.94 HRH3 (0.64) HRH3DRD3TSHRLMNATP53
SCHEMBL9458309 0.94 ALDH1A1 (0.67) ALDH1A1TSHRLMNANPC1MAPT
SCHEMBL16632600 0.94 ALDH1A1 (0.67) ALDH1A1TSHRLMNANPC1MAPT
SCHEMBL4853372 0.94 ALDH1A1 (0.67) ALDH1A1TSHRLMNANPC1MAPT
SCHEMBL9458671 0.94 ALDH1A1 (0.67) ALDH1A1TSHRLMNANPC1MAPT
SCHEMBL9458337 0.94 ALDH1A1 (0.67) ALDH1A1TSHRLMNANPC1MAPT

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
EP-2754679-B1 Copolymer, aqueous ink, and ink cartridge RICOH CO LTD (JP) 2015-06-17 — — EP disclosed
US-8998400-B2 Copolymer, aqueous ink, and ink cartridge RICOH COMPANY, LTD. (JP) 2015-04-07 — — US disclosed
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