SCHEMBL15545286

SCHEMBL15545286

Nc1ccc(NCCN2CCOCC2)cc1Cl

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.52
GAA P10253 1/20 0.52
HSP90AA1 P07900 2/20 0.52
HSP90AB1 P08238 1/20 0.52
ADORA2A P29274 1/20 0.48
ADORA1 P30542 1/20 0.48
MAP3K8 P41279 1/20 0.48
ACHE P22303 1/20 0.46
SIGMAR1 Q99720 4/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
EGFR P00533 1/20 0.46
CNR1 P21554 1/20 0.46
KDM4E B2RXH2 1/20 0.46
LMNA P02545 1/20 0.46
HTT P42858 1/20 0.46
CYP1A2 P05177 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
CYP2C19 P33261 1/20 0.46
HSD17B10 Q99714 1/20 0.46

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
SCHEMBL20607646 0.84 KMT2A (0.47) HSP90AA1HSP90AB1ADORA2AADORA1MAP3K8
SCHEMBL21247508 0.83 CYP3A4 (0.52) ALDH1A1HSP90AA1ADORA2AADORA1ACHE
SCHEMBL16477242 0.83 HTR4 (0.46) ALDH1A1GAAHSP90AA1HSP90AB1SIGMAR1
SCHEMBL30764865 0.83 CYP3A4 (0.52) ALDH1A1HSP90AA1ADORA2AADORA1ACHE
SCHEMBL3861754 0.81 SMN1; SMN2 (0.49) ALDH1A1GAAACHESIGMAR1SMN1; SMN2
SCHEMBL12312314 0.80 ALDH1A1 (0.50) ALDH1A1ACHESMN1; SMN2EGFRKDM4E
SCHEMBL3222264 0.79 CD274 (0.55) ALDH1A1GAAADORA2AADORA1SMN1; SMN2
SCHEMBL20621570 0.79 ADORA2A (0.48) ALDH1A1GAAHSP90AA1HSP90AB1ADORA2A
SCHEMBL15546466 0.78 CYP2C19 (0.54) ALDH1A1GAAHSP90AA1HSP90AB1SMN1; SMN2
Hydrochloric Acid SCHEMBL28380678 0.78 ADORA2A (0.47) ALDH1A1GAAHSP90AA1HSP90AB1ADORA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114773278-A Quinazoline compound and application thereof in antivirus 苏州大学 2022-07-22 CN claimed
CN-114773278-B Quinazoline compound and application thereof in antiviral 苏州大学 2024-07-30 CN disclosed
US-20230140290-A1 SALICYLAMIDE DERIVATIVES AND RELATED METHODS OF MAKING THE BOARD OF REGENTS OF THE UNIV OF TEXAS SY (US) 2023-05-04 US disclosed
EP-4093401-A1 SALICYLAMIDE DERIVATIVES AND RELATED METHODS OF MAKING The Board of Regents of the University of Texas System (US) 2022-11-30 EP disclosed
CN-114773278-A Quinazoline compound and application thereof in antivirus 苏州大学 2022-07-22 CN disclosed
WO-2021151104-A1 SALICYLAMIDE DERIVATIVES AND RELATED METHODS OF MAKING THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2021-07-29 WO disclosed
US-9434695-B2 Nitrogenous heterocyclic derivatives and their application in drugs SUNSHINE LAKE PHARMA CO., LTD (CN) 2016-09-06 US disclosed
EP-2875001-A1 NITROGENOUS HETEROCYCLIC DERIVATIVES AND THEIR APPLICATION IN DRUGS Sunshine Lake Pharma Co., Ltd. (CN) 2015-05-27 EP disclosed
US-20150087639-A1 Nitrogenous Heterocyclic Derivatives And Their Application In Drugs SUNSHINE LAKE PHARMA CO., LTD. (CN) 2015-03-26 US disclosed
WO-2014012360-A1 NITROGENOUS HETEROCYCLIC DERIVATIVES AND THEIR APPLICATION IN DRUGS SUNSHINE LAKE PHARMA CO., LTD. (CN) 2014-01-23 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 (2 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-20230140290-A1 SALICYLAMIDE DERIVATIVES AND RELATED METHODS OF MAKING EIF2AK2, SARS1, ACE ALDH1A1 770/4885GAA 561/4885HSP90AA1 584/4885
US-20150087639-A1 Nitrogenous Heterocyclic Derivatives And Their Application In Drugs TNNC1, TNNI3, IAPP ALDH1A1 1530/4885GAA 2283/4885HSP90AA1 711/4885

“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.