SCHEMBL28890484

SCHEMBL28890484

N#Cc1c(Cl)nc2cccnc2c1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNMA1 Q12791 5/20 0.41
KDM4E B2RXH2 3/20 0.38
ALDH1A1 P00352 3/20 0.38
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
POLB P06746 2/20 0.38
HPGD P15428 1/20 0.38
ALOX12 P18054 1/20 0.38
TDP1 Q9NUW8 2/20 0.36
PRMT5 O14744 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
MAPT P10636 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
CCR1 P32246 2/20 0.35
CCR8 P51685 2/20 0.35
GMNN O75496 1/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
HSP90AA1 P07900 1/20 0.35
MMP2 P08253 1/20 0.35

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
SCHEMBL29958311 1.00 KCNMA1 (0.41) KCNMA1KDM4EALDH1A1KMT2AMEN1
SCHEMBL30101789 0.76 KMT2A (0.36) KDM4EALDH1A1KMT2AMEN1POLB
SCHEMBL22275064 0.76 KMT2A (0.36) KDM4EALDH1A1KMT2AMEN1POLB
SCHEMBL7435562 0.74 PRMT5 (0.46) KDM4EALDH1A1HPGDTDP1PRMT5
SCHEMBL1163209 0.74 ALDH1A1 (0.60) KDM4EALDH1A1KMT2AMEN1POLB
SCHEMBL29799045 0.74 ALDH1A1 (0.60) KDM4EALDH1A1KMT2AMEN1POLB
SCHEMBL4847216 0.73 ALDH1A1 (0.38) KCNMA1KDM4EALDH1A1KMT2AMEN1
SCHEMBL10000604 0.72 KCNMA1 (0.42) KCNMA1KDM4EALDH1A1KMT2ATDP1
SCHEMBL6646968 0.71 KDM4E (0.39) KCNMA1KDM4EALDH1A1POLBHPGD
SCHEMBL24063471 0.70 HTT (0.43) KDM4EALDH1A1KMT2AMEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115362155-B Arylamine derivative, preparation method and medical application thereof 中国医药研究开发中心有限公司 2024-06-18 CN disclosed
CN-115362155-A Arylamine derivatives, and preparation method and medical application thereof 中国医药研究开发中心有限公司 2022-11-18 CN disclosed