SCHEMBL10708686

SCHEMBL10708686

O=C(O)C=CCCC(O)Cl

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.41
▸ GABRR1 P24046 2/20 0.41
▸ GABRR2 P28476 2/20 0.41
▸ BLM P54132 2/20 0.41
▸ GABRR3 A8MPY1 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ APEX1 P27695 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ TP53 P04637 1/20 0.35
▸ EGLN1 Q9GZT9 1/20 0.35
▸ EGLN3 Q9H6Z9 1/20 0.35
▸ TAS1R3 Q7RTX0 1/20 0.33
▸ TAS1R1 Q7RTX1 1/20 0.33
▸ ACHE P22303 1/20 0.32
▸ BACE1 P56817 1/20 0.32
▸ TBXAS1 P24557 4/20 0.32
▸ ARG2 P78540 1/20 0.31
▸ PTPN1 P18031 1/20 0.30

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
SCHEMBL2597441 0.81 TSHR (0.44) TSHRGABRR1GABRR2BLMGABRR3
SCHEMBL28906322 0.80 TSHR (0.39) TSHRGABRR1GABRR2BLMGABRR3
SCHEMBL1185914 0.77 TSHR (0.41) TSHRGABRR1GABRR2BLMGABRR3
SCHEMBL1185911 0.77 TSHR (0.41) TSHRGABRR1GABRR2BLMGABRR3
SCHEMBL10903147 0.76 — —
SCHEMBL2679482 0.76 TSHR (0.39) TSHRGABRR1GABRR2BLMGABRR3
SCHEMBL2679480 0.76 TSHR (0.39) TSHRGABRR1GABRR2BLMGABRR3
SCHEMBL16831513 0.74 TSHR (0.42) TSHRGABRR1GABRR2BLMGABRR3
SCHEMBL16057346 0.74 TSHR (0.42) TSHRGABRR1GABRR2BLMGABRR3
SCHEMBL29888598 0.74 BLM (0.42) TSHRGABRR1GABRR2BLMGABRR3

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-0285966-A2 Thermoplastic molding compositions on the basis of polyphenylene ether BASF Aktiengesellschaft (DE) 1988-10-12 — — EP disclosed
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