SCHEMBL10964293

SCHEMBL10964293

CCCCCCC/C(C=O)=C\c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 1.00
LMNA P02545 1/20 0.97
CES2 O00748 2/20 0.46
CES1 P23141 2/20 0.46
ALDH1A1 P00352 2/20 0.46
TSHR P16473 1/20 0.46
EGFR P00533 1/20 0.43
EPHX2 P34913 2/20 0.43
SOAT2 O75908 1/20 0.42
SOAT1 P35610 1/20 0.42
TUBB4A P04350 2/20 0.42
TUBB P07437 2/20 0.42
TUBA3C P0DPH7 2/20 0.42
TUBA1B P68363 2/20 0.42
TUBA4A P68366 2/20 0.42
TUBB4B P68371 2/20 0.42
TUBB3 Q13509 2/20 0.42
TUBB2A Q13885 2/20 0.42
TUBB8 Q3ZCM7 2/20 0.42
TUBA3E Q6PEY2 2/20 0.42

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
SCHEMBL113171 1.00 TDP1 (1.00) TDP1LMNACES2CES1ALDH1A1
SCHEMBL3398189 1.00 TDP1 (1.00) TDP1LMNACES2CES1ALDH1A1
SCHEMBL9019322 1.00 TDP1 (1.00) TDP1LMNACES2CES1ALDH1A1
SCHEMBL113170 1.00 TDP1 (1.00) TDP1LMNACES2CES1ALDH1A1
SCHEMBL2941510 1.00 TDP1 (1.00) TDP1LMNACES2CES1ALDH1A1
SCHEMBL901344 0.98 LMNA (1.00) TDP1LMNACES2CES1ALDH1A1
SCHEMBL147065 0.98 LMNA (1.00) TDP1LMNACES2CES1ALDH1A1
SCHEMBL12469222 0.98 LMNA (1.00) TDP1LMNACES2CES1ALDH1A1
SCHEMBL113319 0.98 LMNA (1.00) TDP1LMNACES2CES1ALDH1A1
SCHEMBL113320 0.98 LMNA (1.00) TDP1LMNACES2CES1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2899189-B1 Method for the catalytic production of unsaturated aldehydes EVONIK DEGUSSA GMBH (DE) 2017-05-10 EP disclosed
US-9238607-B1 Process for the catalytic production of unsaturated aldehydes EVONIK INDUSTRIES AG (DE) 2016-01-19 US disclosed
US-9238607-B1 Process for the catalytic production of unsaturated aldehydes EVONIK INDUSTRIES AG (DE) 2016-01-19 US disclosed
US-4545912-A AROMATIC POLYETHOXYALKYL SULFONATES MOBIL OIL CORPORATION (US) 1985-10-08 US disclosed
US-4517128-A Two-tailed surfactants having one aromatic containing tail and their use in chemical waterflooding MOBIL OIL CORPORATION (US) 1985-05-14 US disclosed