SCHEMBL29023747

SCHEMBL29023747

[CH2]CNC(=O)c1c2ccccc2cc2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.53
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
HPGD P15428 4/20 0.53
KDM4E B2RXH2 3/20 0.53
HSD17B10 Q99714 2/20 0.53
CYP1A2 P05177 1/20 0.53
GLA P06280 1/20 0.53
CYP2C19 P33261 1/20 0.53
L3MBTL1 Q9Y468 3/20 0.43
CCR1 P32246 1/20 0.40
BCHE P06276 1/20 0.40
ACHE P22303 1/20 0.40
POLB P06746 2/20 0.39
ALOX15 P16050 1/20 0.39
ESR1 P03372 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
LMNA P02545 1/20 0.39
TSHR P16473 1/20 0.38
HTR2A P28223 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
SCHEMBL17119844 0.82 KDM4E (0.53) ALDH1A1MEN1KMT2AHPGDKDM4E
SCHEMBL10100334 0.81 HPGD (0.55) ALDH1A1MEN1KMT2AHPGDKDM4E
SCHEMBL20734832 0.81 ALDH1A1 (0.52) ALDH1A1MEN1KMT2AHPGDKDM4E
SCHEMBL11640078 0.81 TSHR (0.60) ALDH1A1MEN1KMT2AHPGDKDM4E
SCHEMBL28069317 0.79 ALDH1A1 (0.59) ALDH1A1MEN1KMT2AHPGDKDM4E
SCHEMBL30617721 0.79 KDM4E (0.50) ALDH1A1MEN1KMT2AHPGDKDM4E
SCHEMBL13873445 0.79 KDM4E (0.50) ALDH1A1MEN1KMT2AHPGDKDM4E
SCHEMBL4718854 0.78 ALDH1A1 (0.56) ALDH1A1MEN1KMT2AHPGDKDM4E
SCHEMBL11634317 0.78 ALDH1A1 (0.49) ALDH1A1MEN1KMT2AHPGDKDM4E
SCHEMBL27507106 0.77 HSD17B10 (0.61) ALDH1A1MEN1KMT2AHPGDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114867815-B Water repellent composition, method for producing water repellent composition, and fiber product 三井化学株式会社 2024-05-17 CN disclosed
CN-116607324-A Water-repellent and oil-repellent composition for nonwoven fabric and nonwoven fabric product 大金工业株式会社 2023-08-18 CN disclosed
CN-111742031-B Surface treating agent 大金工业株式会社 2023-06-30 CN disclosed