SCHEMBL9522

SCHEMBL9522

O=c1c2c(Br)cccc2nc(CCl)n1Cc1ccccc1Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.43
LMNA P02545 3/20 0.43
TSHR P16473 3/20 0.43
TNF P01375 1/20 0.42
NOD2 Q9HC29 1/20 0.42
NOD1 Q9Y239 1/20 0.42
TDP1 Q9NUW8 2/20 0.41
PIK3CD O00329 1/20 0.41
PIK3R1 P27986 1/20 0.41
PIK3CG P48736 1/20 0.41
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
POLB P06746 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
RAB9A P51151 1/20 0.40
BLM P54132 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GPR35 Q9HC97 1/20 0.40
ALDH1A1 P00352 3/20 0.40
HSD17B10 Q99714 2/20 0.40

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
SCHEMBL16035550 0.84 TDP1 (0.46) LMNATSHRTDP1PIK3CDPIK3CG
SCHEMBL20067789 0.79 TSHR (0.51) TP53LMNATSHRTNFNOD2
SCHEMBL15235648 0.76 MAPT (0.49) TP53LMNATSHRTNFNOD2
SCHEMBL18800195 0.76 TNF (0.42) TP53LMNATSHRTNFNOD2
SCHEMBL11358 0.76 PIK3CD (0.59) PIK3CDPIK3R1PIK3CG
SCHEMBL10924 0.74 CFTR (0.47) LMNAPIK3R1MEN1KMT2APOLB
SCHEMBL22238077 0.74 ALDH1A1 (0.55) TP53LMNATSHRTNFNOD2
SCHEMBL11049 0.72 PIK3CD (0.71) PIK3CDPIK3R1PIK3CG
SCHEMBL20081292 0.71 SMN1; SMN2 (0.44) TP53LMNATSHRTDP1PIK3CG
SCHEMBL19520444 0.71 SMN1; SMN2 (0.36) LMNATSHRPIK3CDMEN1KMT2A

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 70 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10028959-B2 Quinazolin-4 (3H)-one derivatives used as P13 kinase inhibitors RESPIVERT LTD. (GB) 2018-07-24 US disclosed
US-10028959-B2 Quinazolin-4 (3H)-one derivatives used as P13 kinase inhibitors RESPIVERT LTD. (GB) 2018-07-24 US disclosed
US-10028959-B2 Quinazolin-4 (3H)-one derivatives used as P13 kinase inhibitors RESPIVERT LTD. (GB) 2018-07-24 US disclosed
US-20180118754-A1 COMPOUNDS RESPIVERT LTD. (GB) 2018-05-03 US disclosed
US-20180118754-A1 COMPOUNDS RESPIVERT LTD. (GB) 2018-05-03 US disclosed
US-20180118754-A1 COMPOUNDS RESPIVERT LTD. (GB) 2018-05-03 US disclosed
US-9834560-B2 Compounds RESPIVERT LTD. (GB) 2017-12-05 US disclosed
US-9834560-B2 Compounds RESPIVERT LTD. (GB) 2017-12-05 US disclosed
US-9834560-B2 Compounds RESPIVERT LTD. (GB) 2017-12-05 US disclosed
EP-2825202-B1 STABILIZATION OF PHARMACEUTICAL COMPOSITIONS RESPIVERT LTD (GB) 2017-09-06 EP disclosed
US-20130231355-A1 QUINAZOLIN-4 (3H)- ONE DERIVATIVES USED AS P13 KINASE INHIBITORS RESPIVERT LIMITED (US) 2013-09-05 US disclosed
EP-2630149-A1 QUINAZOLIN-4 (3H) -ONE DERIVATIVES USED AS PI3 KINASE INHIBITORS Respivert Limited (GB) 2013-08-28 EP disclosed
EP-2491037-A1 COMPOUNDS Respivert Limited (GB) 2012-08-29 EP disclosed
US-20120208799-A1 COMPOUNDS RESPIVERT LTD (GB) 2012-08-16 US disclosed
US-20120208799-A1 COMPOUNDS RESPIVERT LTD (GB) 2012-08-16 US disclosed
US-20120208799-A1 COMPOUNDS RESPIVERT LTD (GB) 2012-08-16 US disclosed
WO-2012052753-A1 QUINAZOLIN-4 (3H) -ONE DERIVATIVES USED AS PI3 KINASE INHIBITORS RESPIVERT LIMITED (GB) 2012-04-26 WO disclosed
WO-2012052753-A1 QUINAZOLIN-4 (3H) -ONE DERIVATIVES USED AS PI3 KINASE INHIBITORS RESPIVERT LIMITED (GB) 2012-04-26 WO disclosed
WO-2011048111-A1 COMPOUNDS RESPIVERT LIMITED (GB) 2011-04-28 WO disclosed
WO-2011048111-A1 COMPOUNDS RESPIVERT LIMITED (GB) 2011-04-28 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10028959-B2 Quinazolin-4 (3H)-one derivatives used as P13 kinase inhibitors MAP3K13, IRAK3, MAP3K3 TP53 979/4885LMNA 1494/4885TSHR 3943/4885
US-20120208799-A1 COMPOUNDS LTC4S, CYP11B2, LTB4R2 TP53 3866/4885LMNA 1817/4885TSHR 4712/4885
US-20130231355-A1 QUINAZOLIN-4 (3H)- ONE DERIVATIVES USED AS P13 KINASE INHIBITORS MAP3K13, IRAK3, MAP3K3 TP53 979/4885LMNA 1494/4885TSHR 3943/4885
US-20180118754-A1 COMPOUNDS LTC4S, CYP11B2, LTB4R2 TP53 3866/4885LMNA 1817/4885TSHR 4712/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.