SCHEMBL7074870

SCHEMBL7074870

COc1ccc(C=C(F)C(=O)O)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB4A P04350 1/20 0.57
TUBB P07437 1/20 0.57
TUBA3C P0DPH7 1/20 0.57
TUBA1B P68363 1/20 0.57
TUBA4A P68366 1/20 0.57
TUBB4B P68371 1/20 0.57
TUBB3 Q13509 1/20 0.57
TUBB2A Q13885 1/20 0.57
TUBB8 Q3ZCM7 1/20 0.57
TUBA3E Q6PEY2 1/20 0.57
TUBA1A Q71U36 1/20 0.57
TUBA1C Q9BQE3 1/20 0.57
TUBB6 Q9BUF5 1/20 0.57
TUBB2B Q9BVA1 1/20 0.57
TUBB1 Q9H4B7 1/20 0.57
THRB P10828 1/20 0.53
ATM Q13315 1/20 0.53
ALDH1A1 P00352 3/20 0.52
KDM4E B2RXH2 2/20 0.52
MAPT P10636 2/20 0.52

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
SCHEMBL7074865 1.00 TUBB4A (0.57) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL433921 0.81 THRB (0.56) THRBATMALDH1A1KDM4EMAPT
SCHEMBL7820837 0.81 THRB (0.56) THRBATMALDH1A1KDM4EMAPT
SCHEMBL2801414 0.81 THRB (0.56) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL7820839 0.81 THRB (0.56) THRBATMALDH1A1KDM4EMAPT
SCHEMBL3661438 0.81 THRB (0.56) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL7072091 0.80 NPC1 (0.47) ALDH1A1HPGDTSHR
SCHEMBL7072089 0.80 NPC1 (0.47) ALDH1A1HPGDTSHR
SCHEMBL28499551 0.80 MEN1 (0.64) ALDH1A1KDM4EMAPTCYP1A2BCHE
SCHEMBL20500020 0.79 AKR1C3 (0.62) THRBATMALDH1A1KDM4EMAPT

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-0946492-B1 NOVEL 2-FLUOROACRYLIC ACID DERIVATIVES, NOVEL MIXTURES OF HERBICIDES AND ANTIDOTES AND THE USE THEREOF BAYER CROPSCIENCE GMBH (DE) 2003-06-18 EP claimed
CN-118771952-A Trifluoromethyl substitution Process for the synthesis of fluoroolefins 滁州学院 2024-10-15 CN disclosed
CN-117886696-A Synthesis method of difluoroalkyl substituted monofluoroolefin 滁州学院 2024-04-16 CN disclosed
CN-117603252-A Synthesis method of fluorine alkenyl germanium 滁州学院 2024-02-27 CN disclosed