SCHEMBL10423593

SCHEMBL10423593

CCCC(=O)Oc1ccc(-c2ccc(C(=O)OCCC(C)C)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 3/20 0.50
▸ PKM P14618 2/20 0.50
▸ HSD17B10 Q99714 1/20 0.50
▸ KMT2A Q03164 5/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ MAPT P10636 3/20 0.44
▸ RARB P10826 1/20 0.44
▸ BCL9 O00512 1/20 0.44
▸ CTNNB1 P35222 1/20 0.44
▸ CYP1A2 P05177 3/20 0.43
▸ TSHR P16473 3/20 0.43
▸ LMNA P02545 3/20 0.43
▸ ESR1 P03372 3/20 0.43
▸ CYP2D6 P10635 2/20 0.43
▸ CYP2C19 P33261 2/20 0.43
▸ NR1H2 P55055 1/20 0.43
▸ RNASEL Q05823 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ SLC6A2 P23975 2/20 0.43
▸ MEN1 O00255 2/20 0.43

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
SCHEMBL10423311 0.93 MAPK1 (0.48) MAPK1PKMHSD17B10KMT2AMAPT
SCHEMBL10422527 0.91 CYP1A2 (0.48) MAPK1PKMHSD17B10KMT2ARAB9A
SCHEMBL10422555 0.90 KMT2A (0.50) MAPK1PKMHSD17B10KMT2ARAB9A
SCHEMBL10422543 0.90 KMT2A (0.50) MAPK1PKMHSD17B10KMT2ARAB9A
SCHEMBL10422536 0.90 KMT2A (0.50) MAPK1PKMHSD17B10KMT2ARAB9A
SCHEMBL10422521 0.90 KMT2A (0.50) MAPK1PKMHSD17B10KMT2ARAB9A
SCHEMBL10421701 0.90 KMT2A (0.50) MAPK1PKMHSD17B10KMT2ARAB9A
SCHEMBL10422524 0.90 KMT2A (0.50) MAPK1PKMHSD17B10KMT2ARAB9A
SCHEMBL10423445 0.90 KMT2A (0.50) MAPK1PKMHSD17B10KMT2ARAB9A
SCHEMBL10421753 0.90 KMT2A (0.50) MAPK1PKMHSD17B10KMT2ARAB9A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0174816-B1 BIPHENYL-BASED DIESTER COMPOUNDS AND LIQUID CRYSTAL COMPOSITIONS CONTAINING SAME AJINOMOTO CO., INC. (JP) 1990-05-23 — — EP disclosed
US-4831182-A Biphenyl-based diester compounds and liquid crystal compositions containing same AJINOMOTO CO., INC. (JP) 1989-05-16 — — US disclosed
US-4695651-A Biphenyl-based diester compounds and liquid crystal compositions containing same AJINOMOTO CO., INC. (JP) 1987-09-22 — — US disclosed
EP-0174816-A2 Biphenyl-based diester compounds and liquid crystal compositions containing same AJINOMOTO CO., INC. (JP) 1986-03-19 — — EP disclosed
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