SCHEMBL7198174

SCHEMBL7198174

C=C(C=C(C)c1ccccc1)C(=O)OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DEGS1 O15121 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ ELANE P08246 1/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ LMNA P02545 3/20 0.41
▸ HPGD P15428 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ MAPT P10636 4/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ LTB4R Q15722 2/20 0.39
▸ ALDH1A1 P00352 4/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ SRC P12931 1/20 0.39
▸ CES2 O00748 1/20 0.38
▸ CES1 P23141 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ LTB4R2 Q9NPC1 1/20 0.37

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
SCHEMBL6930945 0.82 DEGS1 (0.47) DEGS1TSHRELANESMN1; SMN2LMNA
SCHEMBL14319107 0.79 TSHR (0.42) TSHRLMNAKMT2AMAPTALDH1A1
SCHEMBL7995954 0.78 TSHR (0.52) DEGS1TSHRSMN1; SMN2LMNAHPGD
SCHEMBL7995955 0.78 TSHR (0.52) DEGS1TSHRSMN1; SMN2LMNAHPGD
SCHEMBL10830070 0.78 TSHR (0.52) DEGS1TSHRSMN1; SMN2LMNAHPGD
SCHEMBL9538705 0.76 TSHR (0.42) DEGS1TSHRELANELMNAKMT2A
SCHEMBL8921919 0.76 TSHR (0.42) TSHRELANESMN1; SMN2LMNAHPGD
Iodobenzene SCHEMBL10995443 0.75 ELANE (0.40) DEGS1TSHRELANESMN1; SMN2LMNA
Phthalic Acid SCHEMBL16932936 0.74 ALDH1A1 (0.42) TSHRLMNAHPGDTP53KMT2A
SCHEMBL1413965 0.74 TSHR (0.47) DEGS1TSHRELANESMN1; SMN2LMNA

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
US-6596899-B1 Use in living free radical polymerization as well as to form telechelic polymers; Use in RAFT polymerization; reversible addition fragmentation chain transfer polymerization NOVEON IP HOLDINGS CORP. 2003-07-22 — — US disclosed
US-4027061-A NITRILE POLYMER, POLYVINYL BUTYRAL AND POLYURETHANES MONSANTO COMPANY (US) 1977-05-31 — — US disclosed
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