SCHEMBL28528453

SCHEMBL28528453

O=C1CC=CC2=C1NC(c1ccc(F)cc1)CC2

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.36
LMNA P02545 1/20 0.32
KCNH2 Q12809 1/20 0.31
GPR174 Q9BXC1 1/20 0.30

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
SCHEMBL28537495 0.86 ALDH1A1 (0.35)
SCHEMBL28526867 0.86 SMN1; SMN2 (0.34) LMNA
SCHEMBL28526866 0.85 PARP1 (0.39)
SCHEMBL28540666 0.76 HTR2C (0.38) TDP1
SCHEMBL28540668 0.74 DDB1 (0.44) GPR174
SCHEMBL28528607 0.73 KMT2A (0.40) LMNA
SCHEMBL23878342 0.72 TDP1 (0.46) TDP1LMNAKCNH2
SCHEMBL22039449 0.72 TDP1 (0.46) TDP1LMNAKCNH2
SCHEMBL7237762 0.72 TDP1 (0.46) TDP1LMNAKCNH2
SCHEMBL28907927 0.71 ALDH1A1 (0.32)

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-112480112-B Method for synthesizing substituted dihydrophenanthroline compound 浙江工业大学 2021-10-15 CN disclosed
CN-112480112-A Method for synthesizing substituted dihydrophenanthroline compound 浙江工业大学 2021-03-12 CN disclosed