SCHEMBL25857109

SCHEMBL25857109

Cc1ccc(C2CC2c2ccc(I)c(N)c2)cc1N

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB4A P04350 6/20 0.42
TUBB P07437 6/20 0.42
TUBA3C P0DPH7 6/20 0.42
TUBA1B P68363 6/20 0.42
TUBA4A P68366 6/20 0.42
TUBB4B P68371 6/20 0.42
TUBB3 Q13509 6/20 0.42
TUBB2A Q13885 6/20 0.42
TUBB8 Q3ZCM7 6/20 0.42
TUBA3E Q6PEY2 6/20 0.42
TUBA1A Q71U36 6/20 0.42
TUBA1C Q9BQE3 6/20 0.42
TUBB6 Q9BUF5 6/20 0.42
TUBB2B Q9BVA1 6/20 0.42
TUBB1 Q9H4B7 6/20 0.42
TDP1 Q9NUW8 2/20 0.39
ALDH1A1 P00352 1/20 0.39
CASP1 P29466 1/20 0.39
HTR2A P28223 2/20 0.39
HTR2C P28335 2/20 0.39

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
SCHEMBL3713659 0.70 TDP1 (0.48) TDP1ALDH1A1CASP1HTR2AHTR2C
SCHEMBL3701804 0.70 HDAC1 (0.37) CYP3A4
SCHEMBL20975678 0.66 BACE1 (0.47) TDP1ALDH1A1CASP1CYP3A4
SCHEMBL25558938 0.66 SLC6A2 (0.45) TDP1ALDH1A1CASP1CYP3A4MAPT
SCHEMBL19175414 0.64 SLC6A2 (0.42) TDP1ALDH1A1CASP1CYP3A4MAPT
SCHEMBL13764720 0.64
SCHEMBL792455 0.64
SCHEMBL616552 0.64
SCHEMBL29439824 0.64
SCHEMBL14183095 0.63 TDP1 (0.41) TDP1ALDH1A1CASP1CYP3A4MAPT

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
WO-2023133943-A1 CROSS-LINKED POLYAMIC ACID ESTER AND PREPARATION METHOD THEREFOR, POLYIMIDE COMPOSITION COMPRISING SAME, AND METHOD FOR PREPARING POLYIMIDE RESIN FILM 深圳职业技术学院 2023-07-20 WO disclosed