SCHEMBL9821131

SCHEMBL9821131

CC(=O)c1c(C)nc2ccccc2c1NCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.59
RAD52 P43351 2/20 0.59
POLB P06746 1/20 0.59
TP53 P04637 1/20 0.57
HSD17B10 Q99714 1/20 0.57
APP P05067 2/20 0.51
ACHE P22303 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.48
KDM4E B2RXH2 3/20 0.48
ALDH1A1 P00352 2/20 0.48
HPGD P15428 1/20 0.48
USP2 O75604 1/20 0.47
ALOX15 P16050 1/20 0.47
MAPK1 P28482 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
MEN1 O00255 2/20 0.47
LMNA P02545 1/20 0.46
ATM Q13315 1/20 0.46
HTT P42858 3/20 0.46
GRM5 P41594 1/20 0.46

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
Hydrochloric Acid SCHEMBL9821072 0.99 KMT2A (0.57) KMT2ARAD52POLBTP53HSD17B10
SCHEMBL6658584 0.91 HSD17B10 (0.51) KMT2ARAD52POLBTP53HSD17B10
SCHEMBL9821213 0.91 HTT (0.52) KMT2ARAD52POLBTP53HSD17B10
SCHEMBL6650864 0.91 TP53 (0.51) KMT2ARAD52POLBTP53HSD17B10
SCHEMBL6652586 0.90 KMT2A (0.60) KMT2ARAD52POLBTP53HSD17B10
Hydrochloric Acid SCHEMBL10567928 0.90 KMT2A (0.53) KMT2ARAD52POLBTP53HSD17B10
SCHEMBL7649838 0.88 APP (0.54) KMT2ARAD52POLBTP53HSD17B10
SCHEMBL7646678 0.87 KMT2A (0.61) KMT2ARAD52POLBTP53HSD17B10
SCHEMBL9821276 0.84 MEN1 (0.54) KMT2APOLBTP53HSD17B10SMN1; SMN2
SCHEMBL6657077 0.83 TP53 (0.45) KMT2ARAD52POLBTP53HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4789678-A Memory enhancing α-alkyl-4-amino-3-quinolinemethanols and 1-(4-aralkylamino-3-quinolinyl)alkanones and related compounds HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1988-12-06 US claimed
EP-0258755-B1 ALPHA-ALKYL-4-AMINO-3-QUINOLINE-METHANOLS AND 1-(4-ARALKYLAMINO-3-QUINOLINYL) ALKANONES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1991-09-11 EP disclosed
US-4840972-A Relief from memory dysfunction with α-alkyl-4-amino-3-quinolinemethanols and 1-(4-aralkylamino-3-quinolinyl)alkanones and related compounds HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1989-06-20 US disclosed
US-4789678-A Memory enhancing α-alkyl-4-amino-3-quinolinemethanols and 1-(4-aralkylamino-3-quinolinyl)alkanones and related compounds HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1988-12-06 US disclosed
EP-0258755-A1 Alpha-alkyl-4-amino-3-quinoline-methanols and 1-(4-aralkylamino-3-quinolinyl) alkanones, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1988-03-09 EP disclosed