SCHEMBL22720135

SCHEMBL22720135

Nc1cc(Br)ccc1C(=O)Nc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPD1 P10809 1/20 0.55
HSPE1 P61604 1/20 0.55
GPR27 Q9NS67 4/20 0.54
AVPR2 P30518 1/20 0.54
F12 P00748 1/20 0.53
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
SORT1 Q99523 2/20 0.52
ALDH1A1 P00352 3/20 0.51
P2RX1 P51575 1/20 0.51
HTT P42858 1/20 0.51
KMT2A Q03164 3/20 0.50
MEN1 O00255 2/20 0.50
TP53 P04637 1/20 0.50
MAOA P21397 1/20 0.50
MAOB P27338 1/20 0.50
LMNA P02545 1/20 0.49
GAA P10253 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
PRKCI P41743 1/20 0.49

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
SCHEMBL10289025 0.87 POLB (0.61) HSPD1HSPE1GPR27AVPR2F12
SCHEMBL15920888 0.86 ALDH1A1 (0.59) GPR27AVPR2NPC1RAB9AALDH1A1
SCHEMBL2545034 0.84 MAPT (0.50) SORT1ALDH1A1KMT2AMEN1TP53
SCHEMBL15920940 0.84 KMT2A (0.69) NPC1RAB9ASORT1ALDH1A1P2RX1
SCHEMBL3341952 0.83 ALDH1A1 (0.53) ALDH1A1P2RX1HTTKMT2AMEN1
SCHEMBL23825504 0.82 SORT1 (0.74) HSPD1HSPE1GPR27AVPR2F12
SCHEMBL29980628 0.82 SORT1 (0.74) HSPD1HSPE1GPR27AVPR2F12
SCHEMBL19329033 0.81 MEN1 (0.65) HSPD1HSPE1GPR27AVPR2F12
SCHEMBL19350786 0.81 GPR27 (0.74) HSPD1HSPE1GPR27AVPR2F12
SCHEMBL10430505 0.81 FADS1 (0.56) GPR27AVPR2NPC1RAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117510415-A Synthesis method of quinazolinone compound 中国人民解放军军事科学院防化研究院 2024-02-06 CN disclosed
WO-2020239050-A1 2-(2-CHLORO-4-METHYLPHENYL)QUINAZOLINE-4(3H)-KETONE COMPOUND AND MEDICAL USE THEREOF 中国人民解放军军事科学院军事医学研究院 2020-12-03 WO disclosed
CN-110041272-B 2- (2-chlorphenyl) quinazoline-4 (3H) -ketone derivative and preparation method and application thereof 中国人民解放军军事科学院军事医学研究院 2020-10-30 CN disclosed
CN-110041273-B 2- (2-chloro-4-methylphenyl) quinazoline-4 (3H) -ketone compound and medical application thereof 中国人民解放军军事科学院军事医学研究院 2020-10-20 CN disclosed
CN-110041273-A 2- (the chloro- 4- aminomethyl phenyl of 2-) quinazoline -4 (3H) -one class compound and its medical usage 中国人民解放军军事科学院军事医学研究院 2019-07-23 CN disclosed
CN-110041272-A 2- (2- chlorphenyl) quinazoline -4 (3H) -one analog derivative and its preparation method and application 中国人民解放军军事科学院军事医学研究院 2019-07-23 CN disclosed