SCHEMBL10517153

SCHEMBL10517153

CSc1ncc(Br)c(C(=O)Cl)n1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.54
MEN1 O00255 5/20 0.54
MAPT P10636 3/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KDM4E B2RXH2 1/20 0.43
LMNA P02545 1/20 0.43
ALDH1A1 P00352 1/20 0.43
NPC1 O15118 1/20 0.41
AHR P35869 1/20 0.37
NTRK1 P04629 1/20 0.36
TP53 P04637 1/20 0.34

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
SCHEMBL29776216 1.00 KMT2A (0.54) KMT2AMEN1MAPTSMN1; SMN2KDM4E
SCHEMBL29428717 0.84 KMT2A (0.65) KMT2AMEN1MAPTSMN1; SMN2KDM4E
SCHEMBL1325225 0.84 KMT2A (0.65) KMT2AMEN1MAPTSMN1; SMN2KDM4E
SCHEMBL6039621 0.81 KMT2A (0.75) KMT2AMEN1MAPTSMN1; SMN2KDM4E
SCHEMBL30168472 0.81 KMT2A (0.75) KMT2AMEN1MAPTSMN1; SMN2KDM4E
SCHEMBL29439591 0.80 KMT2A (0.47) KMT2AMEN1MAPTSMN1; SMN2KDM4E
SCHEMBL628538 0.80 KMT2A (0.47) KMT2AMEN1MAPTSMN1; SMN2KDM4E
SCHEMBL16659002 0.77 NPC1 (0.34) KMT2ANPC1NTRK1
SCHEMBL2160733 0.76 MEN1 (0.54) KMT2AMEN1MAPTSMN1; SMN2KDM4E
SCHEMBL10976128 0.76 MEN1 (0.44) KMT2AMEN1MAPTSMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110914277-B Imidazo [1,2-b ] pyrimido [4,5-d ] pyridazin-5 (6H) -one compounds and application thereof 上海瑛派药业有限公司 2022-08-09 CN disclosed
US-11345710-B2 Imidazo[1,2-b]pyrimido[4,5-d]pyridazin-5(6H)-ones and the use thereof Impact Therapeutics (Shanghai), Inc (CN) 2022-05-31 US disclosed
US-20200131192-A1 IMIDAZO[1,2-b]PYRIMIDO[4,5-d]PYRIDAZIN-5(6H)-ONES AND THE USE THEREOF IMPACT THERAPEUTICS, INC. (CN) 2020-04-30 US disclosed
CN-110914277-A Imidazo [1,2-b ] pyrimido [4,5-d ] pyridazin-5 (6H) -one compounds and application thereof 上海瑛派药业有限公司 2020-03-24 CN disclosed
EP-2934518-B1 SPIROCYCLIC CETP INHIBITORS MERCK SHARP & DOHME (US) 2020-02-19 EP disclosed
US-9717714-B2 Spirocyclic CETP inhibitors MERCK SHARP & DOHME CORP. (US) 2017-08-01 US disclosed
US-9717714-B2 Spirocyclic CETP inhibitors MERCK SHARP & DOHME CORP. (US) 2017-08-01 US disclosed
EP-2844252-B1 CYCLIC AMINE SUBSTITUTED HETEROCYCLIC COMPOUNDS AS CETP INHIBITORS MERCK SHARP & DOHME (US) 2016-11-30 EP disclosed
US-20160229825-A1 SYNTHETIC PROCESS FOR PREPARING 2-FUROIC ACID DERIVATIVES DERMIRA, INC. 2016-08-11 US disclosed
US-9353101-B2 Cyclic amine substituted heterocyclic CETP inhibitors MERCK SHARP & DOHME CORP. (US) 2016-05-31 US disclosed
US-20150342931-A1 SPIROCYCLIC CETP INHIBITORS MERCK SHARP & DOHME CORP. (US) 2015-12-03 US disclosed
US-20150342931-A1 SPIROCYCLIC CETP INHIBITORS MERCK SHARP & DOHME CORP. (US) 2015-12-03 US disclosed
EP-2934518-A1 SPIROCYCLIC CETP INHIBITORS Merck Sharp & Dohme Corp. (US) 2015-10-28 EP disclosed
US-20150111866-A1 CYCLIC AMINE SUBSTITUTED HETEROCYCLIC CETP INHIBITORS MERCK SHARP & DOHME CORP. (US) 2015-04-23 US disclosed
WO-2014099836-A1 SPIROCYCLIC CETP INHIBITORS MERCK SHARP & DOHME CORP. (US) 2014-06-26 WO disclosed
WO-2014099836-A1 SPIROCYCLIC CETP INHIBITORS MERCK SHARP & DOHME CORP. (US) 2014-06-26 WO disclosed
EP-0316491-A1 Herbicidal 2-pyridyl and 2-pyrimidine carbonyl 1,3-cyclohexanediones STAUFFER AGRICULTURAL CHEMICALS COMPANY, INC. (US) 1989-05-24 EP disclosed
US-4708732-A 2-(pyrimidinecarbonyl)-1,3-cyclohexanediones and their use as herbicidal agents STAUFFER CHEMICAL COMPANY (US) 1987-11-24 US 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 (5 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-20150111866-A1 CYCLIC AMINE SUBSTITUTED HETEROCYCLIC CETP INHIBITORS CETP, APOB, MTTP KMT2A 1708/4885MEN1 2325/4885MAPT 2846/4885
US-20200131192-A1 IMIDAZO[1,2-b]PYRIMIDO[4,5-d]PYRIDAZIN-5(6H)-ONES AND THE USE THEREOF WEE1, WEE2, CCNE1 KMT2A 1427/4885MEN1 2280/4885MAPT 4290/4885
US-20150342931-A1 SPIROCYCLIC CETP INHIBITORS CETP, MTTP, LCAT KMT2A 4339/4885MEN1 3568/4885MAPT 2950/4885
US-11345710-B2 Imidazo[1,2-b]pyrimido[4,5-d]pyridazin-5(6H)-ones and the use thereof WEE1, WEE2, CCNE1 KMT2A 1427/4885MEN1 2280/4885MAPT 4290/4885
US-20160229825-A1 SYNTHETIC PROCESS FOR PREPARING 2-FUROIC ACID DERIVATIVES ALAD, CYP4F2, CYP2F1 KMT2A 1455/4885MEN1 2178/4885MAPT 4464/4885

“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.