SCHEMBL9686146

SCHEMBL9686146

CCn1cc(C=O)c2nc(N3CCN(Cc4ccccc4)CC3)ncc2c1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 4/20 0.46
LMNA P02545 3/20 0.46
ALDH1A1 P00352 4/20 0.43
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
TSHR P16473 3/20 0.41
HPGD P15428 2/20 0.41
GAA P10253 2/20 0.41
HSD17B10 Q99714 1/20 0.41
TRPA1 O75762 1/20 0.40
BCL2L1 Q07817 2/20 0.39
USP2 O75604 1/20 0.39
MAPT P10636 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HIF1A Q16665 1/20 0.39
DRD2 P14416 2/20 0.39
DRD4 P21917 2/20 0.39
DRD3 P35462 2/20 0.39

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
SCHEMBL9686660 0.87 HTT (0.48) HTTLMNAALDH1A1NPC1RAB9A
SCHEMBL9684377 0.83 PTPN11 (0.42) LMNAALDH1A1HPGDHSD17B10MAPT
SCHEMBL9686741 0.81 CYP1A2 (0.41) LMNAALDH1A1SMN1; SMN2TSHRHPGD
SCHEMBL9684556 0.80 LMNA (0.51) HTTLMNAALDH1A1NPC1RAB9A
SCHEMBL11143648 0.73 LMNA (0.73) LMNAALDH1A1HPGDHSD17B10NPSR1
SCHEMBL10824274 0.72 NPC1 (0.48) HTTLMNAALDH1A1NPC1RAB9A
SCHEMBL9686692 0.70 ABCC1 (0.41) LMNAALDH1A1SMN1; SMN2TSHRHPGD
SCHEMBL9686594 0.70 HTT (0.52) HTTLMNAALDH1A1NPC1RAB9A
SCHEMBL11583159 0.70 LMNA (0.59) LMNAALDH1A1TSHRHPGDHSD17B10
SCHEMBL11874422 0.69 LMNA (0.57) LMNAALDH1A1TSHRHPGDHSD17B10

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
EP-0188094-B1 QUINAZOLINE DERIVATIVES AND ANTIHYPERTENSIVE PREPARATIONS CONTAINING SAME AS EFFECTIVE COMPONENTS MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1992-03-18 EP disclosed
US-4734418-A Quinazoline compounds and antihypertensives MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1988-03-29 US disclosed
EP-0188094-A2 Quinazoline derivatives and antihypertensive preparations containing same as effective components MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1986-07-23 EP disclosed