SCHEMBL28929167

SCHEMBL28929167

COc1c(Cl)cc(Cl)c2ccc(Nc3ncccc3N3CCOCC3)nc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 2/20 0.40
▸ FGFR3 P22607 4/20 0.40
▸ FGFR2 P21802 2/20 0.40
▸ HTT P42858 4/20 0.39
▸ LMNA P02545 3/20 0.39
▸ TP53 P04637 3/20 0.39
▸ MAPT P10636 3/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ MITF O75030 2/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ JAK2 O60674 1/20 0.39
▸ TYK2 P29597 1/20 0.39
▸ RAB9A P51151 3/20 0.38
▸ POLB P06746 2/20 0.38
▸ NPSR1 Q6W5P4 2/20 0.38
▸ NPC1 O15118 2/20 0.38
▸ NFKB1 P19838 2/20 0.38

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
SCHEMBL28663835 0.86 KDM4E (0.42) EGFRFGFR3FGFR2TP53KDM4E
SCHEMBL28929164 0.81 CHEK1 (0.43) JAK2TYK2INSRALKKCNH2
SCHEMBL28660403 0.74 HTR1A (0.42) EGFRALK
SCHEMBL28672740 0.71 ALDH1A1 (0.48) HTTMAPTSMN1; SMN2KDM4EMAPK1
SCHEMBL28660399 0.71 ALDH1A1 (0.39) LMNAMAPTSMN1; SMN2KDM4EMAPK1
SCHEMBL28654896 0.70 BRD4 (0.45) EGFRFGFR3TNIK
SCHEMBL28663832 0.67 INSR (0.46) JAK2INSRALKKCNH2TNIK
SCHEMBL22970837 0.67 POLB (0.48) MAPTSMN1; SMN2ALOX15MAPK1RAB9A
SCHEMBL28445775 0.67 AURKA (0.47) EGFRKDM4ETYK2POLBNPSR1
SCHEMBL28663676 0.67 ALDH1A1 (0.45) SMN1; SMN2ALOX15POLBALDH1A1

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-113717158-A 2- (N- (pyridine-2-yl) amino) quinoline derivative and application thereof 河南省人民医院 2021-11-30 — — CN claimed
CN-113717158-A 2- (N- (pyridine-2-yl) amino) quinoline derivative and application thereof 河南省人民医院 2021-11-30 — — CN disclosed
Send feedback