SCHEMBL28112588

SCHEMBL28112588

O=CNNc1ccc(Cl)nc1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KCNQ3 O43525 16/20 0.44
KCNQ2 O43526 16/20 0.44
KCNE1 P15382 12/20 0.44
KCNQ1 P51787 12/20 0.44
BACE1 P56817 1/20 0.42
ALDH1A1 P00352 1/20 0.40
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NAPRT Q6XQN6 1/20 0.37
TNF P01375 1/20 0.36

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
SCHEMBL182090 0.80 KCNQ3 (0.46) KCNQ3KCNQ2KCNE1KCNQ1BACE1
SCHEMBL29049784 0.78 SMN1; SMN2 (0.33) RAB9ASMN1; SMN2
SCHEMBL1758240 0.73 PTGS2 (0.45) ALDH1A1RAB9ASMN1; SMN2
SCHEMBL11609233 0.70
SCHEMBL12781201 0.69
SCHEMBL9644441 0.69 ALDH1A1 (0.31) ALDH1A1
SCHEMBL29418020 0.69
SCHEMBL6671214 0.69 TGM2 (0.41) ALDH1A1RAB9A
SCHEMBL22862348 0.69
SCHEMBL1198471 0.69

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
CN-116887609-A Perovskite thin film layer and preparation method thereof, perovskite silicon laminated solar cell and preparation method thereof 通威太阳能(成都)有限公司 2023-10-13 CN claimed
CN-116887609-A Perovskite thin film layer and preparation method thereof, perovskite silicon laminated solar cell and preparation method thereof 通威太阳能(成都)有限公司 2023-10-13 CN disclosed
CN-106146487-B Pyridylmethyl dithiocarbonic acid hetero-aromatic ring alkyl esters compound and its preparation method and application 北京大学 2019-05-10 CN disclosed
CN-106146487-A Pyridylmethyl dithiocarbonic acid hetero-aromatic ring alkyl esters compound and its production and use 北京大学 2016-11-23 CN disclosed