SCHEMBL3393329

SCHEMBL3393329

Nc1nc(Cl)c2c(-c3ccccc3)n[nH]c2n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.44
KDM4E B2RXH2 6/20 0.44
ALDH1A1 P00352 5/20 0.44
ADORA2A P29274 5/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
GAA P10253 2/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
HSD17B10 Q99714 1/20 0.44
NUDT1 P36639 1/20 0.44
PDE5A O76074 1/20 0.43
PDE1A P54750 1/20 0.43
PDE1B Q01064 1/20 0.43
PDE3B Q13370 1/20 0.43
PDE1C Q14123 1/20 0.43
PDE3A Q14432 1/20 0.43
LMNA P02545 1/20 0.43
GLA P06280 1/20 0.43
CHUK O15111 1/20 0.43
XDH P47989 1/20 0.42

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
SCHEMBL5786736 0.84 ALDH1A1 (0.46) HPGDKDM4EALDH1A1SMN1; SMN2GAA
SCHEMBL5787312 0.83 HPGD (0.41) HPGDKDM4EALDH1A1SMN1; SMN2GAA
SCHEMBL14019129 0.78 KDM4E (0.48) HPGDKDM4EALDH1A1SMN1; SMN2GAA
SCHEMBL4928638 0.78 YTHDC1 (0.43) HPGDKDM4EALDH1A1SMN1; SMN2GAA
SCHEMBL4753476 0.78 CHUK (0.51) HPGDKDM4EALDH1A1ADORA2ASMN1; SMN2
SCHEMBL14441710 0.76 IDO1 (0.42) HPGDADORA2ANPSR1ADORA1IDO1
SCHEMBL22911122 0.74 CHUK (0.43) CHUKDHFR
SCHEMBL18040266 0.73 DPP4 (0.49) HPGDKDM4EALDH1A1ADORA2ASMN1; SMN2
SCHEMBL26708031 0.72 KDM4E (0.61) HPGDKDM4EALDH1A1ADORA2ASMN1; SMN2
SCHEMBL16475309 0.72 ALDH1A1 (0.56) HPGDKDM4EALDH1A1SMN1; SMN2GAA

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
EP-3546462-B1 NOVEL OXOISOQUINOLINE DERIVATIVE CARNA BIOSCIENCES INC (JP) 2024-01-03 EP disclosed
CN-109963852-B Oxoisoquinoline derivatives 卡尔那生物科学株式会社 2021-12-03 CN disclosed
US-10793575-B2 Oxoisoquinoline derivatives CARNA BIOSCIENCES, INC. (JP) 2020-10-06 US disclosed
EP-3546462-A1 NOVEL OXOISOQUINOLINE DERIVATIVE Carna Biosciences Inc. (JP) 2019-10-02 EP disclosed
EP-2145888-A1 Deazapurine derivatives as HSP90-Inhibitors Conforma Therapeutics Corporation (US) 2010-01-20 EP disclosed
US-20070111996-A1 Pyrazolopyrimidines and related analogs as HSP90-inhibitors CONFORMA THERAPEUTICS CORPORATION (US) 2007-05-17 US disclosed
US-20070111996-A1 Pyrazolopyrimidines and related analogs as HSP90-inhibitors CONFORMA THERAPEUTICS CORPORATION (US) 2007-05-17 US disclosed
US-20070111996-A1 Pyrazolopyrimidines and related analogs as HSP90-inhibitors CONFORMA THERAPEUTICS CORPORATION (US) 2007-05-17 US disclosed
US-7148228-B2 Pyrazolopyrimidines and related analogs as HSP90-inhibitors CONFORMA THERAPEUTICS CORPORATION (US) 2006-12-12 US disclosed
EP-1670802-A2 NOVEL HETEROCYCLIC COMPOUNDS AS HSP90-INHIBITORS Conforma Therapeutic Corporation (US) 2006-06-21 EP disclosed
US-20050119282-A1 Pyrazolopyrimidines and related analogs as HSP90-inhibitors CONFORMA THERAPEUTICS CORPORATION 2005-06-02 US disclosed
WO-2005028434-A2 NOVEL HETEROCYCLIC COMPOUNDS AS HSP90-INHIBITORS CONFORMA THERAPEUTICS CORPORATION (US) 2005-03-31 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 (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-20050119282-A1 Pyrazolopyrimidines and related analogs as HSP90-inhibitors HSP90AB2P, HSP90AB1, HSP90AA1 HPGD 138/4885KDM4E 4076/4885ALDH1A1 1852/4885
US-10793575-B2 Oxoisoquinoline derivatives BCL6, BCL6B, BCL3 HPGD 2334/4885KDM4E 875/4885ALDH1A1 2504/4885
US-20070111996-A1 Pyrazolopyrimidines and related analogs as HSP90-inhibitors HSP90AB2P, HSP90AB1, HSP90AA1 HPGD 138/4885KDM4E 4076/4885ALDH1A1 1852/4885

“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.