SCHEMBL7672177

SCHEMBL7672177

CCCCn1cnc2c(Cl)nc(Nc3ccc(OCC)nc3)nc21

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CCNE1 P24864 9/20 0.44
CDK2 P24941 9/20 0.44
PDGFRA P16234 8/20 0.44
NR3C1 P04150 2/20 0.39
CTSL P07711 3/20 0.38
TMIGD3 P0DMS9 1/20 0.36
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36
POLB P06746 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
KDM4E B2RXH2 1/20 0.36
NFKB1 P19838 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36

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
SCHEMBL7666287 0.89 PDGFRA (0.41) CCNE1CDK2PDGFRANR3C1CTSL
SCHEMBL7674135 0.87 PDGFRA (0.43) CCNE1CDK2PDGFRANR3C1CTSL
SCHEMBL18232537 0.86 PDGFRA (0.46) CCNE1CDK2PDGFRANR3C1CTSL
SCHEMBL20363222 0.84 MEN1 (0.35) POLBMEN1KMT2AKDM4ENFKB1
SCHEMBL7672313 0.84 POLA1 (0.38) CCNE1CDK2PDGFRANR3C1POLB
SCHEMBL7670257 0.84 PDGFRA (0.38) CCNE1CDK2PDGFRANR3C1CTSL
SCHEMBL7365457 0.84 PDGFRA (0.39) CCNE1CDK2PDGFRANR3C1CTSL
SCHEMBL7661658 0.84 PDGFRA (0.38) CCNE1CDK2PDGFRANR3C1CTSL
SCHEMBL7356565 0.84 PDGFRA (0.38) CCNE1CDK2PDGFRANR3C1CTSL
SCHEMBL7661594 0.83 CDK2 (0.43) CCNE1CDK2PDGFRACTSLMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180289718-A1 FUSED IMIDAZOLE COMPOUNDS ONO PHARMACEUTICAL CO., LTD. (JP) 2018-10-11 US claimed
EP-3099672-A1 FUSED IMIDAZOLE COMPOUNDS ONO Pharmaceutical Co., Ltd. (JP) 2016-12-07 EP claimed
US-20160331757-A1 FUSED IMIDAZOLE COMPOUNDS ONO PHARMACEUTICAL CO., LTD. (JP) 2016-11-17 US claimed
WO-2015115673-A1 FUSED IMIDAZOLE COMPOUNDS ONO PHARMACEUTICAL CO., LTD. (JP) 2015-08-06 WO claimed
US-20180289718-A1 FUSED IMIDAZOLE COMPOUNDS ONO PHARMACEUTICAL CO., LTD. (JP) 2018-10-11 US disclosed
US-10016439-B2 Fused imidazole compounds ONO PHARMACEUTICAL CO., LTD. (JP) 2018-07-10 US disclosed
EP-3099672-A1 FUSED IMIDAZOLE COMPOUNDS ONO Pharmaceutical Co., Ltd. (JP) 2016-12-07 EP disclosed
US-20160331757-A1 FUSED IMIDAZOLE COMPOUNDS ONO PHARMACEUTICAL CO., LTD. (JP) 2016-11-17 US disclosed
US-20160331757-A1 FUSED IMIDAZOLE COMPOUNDS ONO PHARMACEUTICAL CO., LTD. (JP) 2016-11-17 US disclosed
WO-2015115673-A1 FUSED IMIDAZOLE COMPOUNDS ONO PHARMACEUTICAL CO., LTD. (JP) 2015-08-06 WO disclosed
WO-2015115673-A1 FUSED IMIDAZOLE COMPOUNDS ONO PHARMACEUTICAL CO., LTD. (JP) 2015-08-06 WO disclosed
US-6414147-B1 DIAGNOSIS AND TREATMENT OF ANXIETY, DEPRESSION, SLEEP AND SEIZURE DISORDERS, DOWN'S SYNDROME, OVERDOSE WITH BENZODIAZEPINE DRUGS, AND FOR ENHANCEMENT OF MEMORY NEUROGEN CORPORATION 2002-07-02 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 (3 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-20180289718-A1 FUSED IMIDAZOLE COMPOUNDS GABRA5, CHRNA5, GABRP CCNE1 3196/4885CDK2 3267/4885PDGFRA 2158/4885
US-20160331757-A1 FUSED IMIDAZOLE COMPOUNDS GABRA5, CHRNA5, GABRP CCNE1 3196/4885CDK2 3267/4885PDGFRA 2158/4885
US-10016439-B2 Fused imidazole compounds GABRA5, CHRNA5, GABRP CCNE1 3196/4885CDK2 3267/4885PDGFRA 2158/4885

“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.